SCHEMBL4763153

SCHEMBL4763153

Cc1cccc(CN(CCO)CCO)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
HSD17B10 Q99714 1/20 0.54
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HTT P42858 2/20 0.49
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
MAPK1 P28482 1/20 0.49
LMNA P02545 1/20 0.48
CYP2D6 P10635 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP1A2 P05177 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TAAR1 Q96RJ0 2/20 0.44
RECQL P46063 1/20 0.43
IDO1 P14902 2/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15473291 0.93 TSHR (0.63) TSHRHSD17B10MEN1KMT2AHTT
SCHEMBL14874503 0.86 MEN1 (0.57) TSHRHSD17B10MEN1KMT2AHTT
SCHEMBL13175212 0.84 CYP2D6 (0.56) HSD17B10CYP2D6CYP2C9CYP2C19TAAR1
SCHEMBL13775217 0.83 HRH3 (0.52) TSHRHSD17B10CYP2D6CYP2C9CYP2C19
SCHEMBL18697659 0.81 TSHR (0.57) TSHRHSD17B10MEN1KMT2AHTT
SCHEMBL24885675 0.80 ALDH1A1 (0.55) TSHRHSD17B10MEN1KMT2AHTT
SCHEMBL12772089 0.79 TAS2R14 (0.50) TSHRHTTALDH1A1KDM4ECYP2D6
SCHEMBL12772084 0.79 TAAR1 (0.48) TSHRKDM4EHPGDMAPK1CYP2D6
SCHEMBL14544445 0.78 HTT (0.57) TSHRHSD17B10MEN1KMT2AHTT
SCHEMBL807255 0.78 HSD17B10 (0.50) TSHRHSD17B10MEN1KMT2AHTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 115 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230346812-A1 METHODS FOR TREATING SARS COV-2 INFECTIONS GILEAD SCIENCES, INC. 2023-11-02 US disclosed
US-11660307-B2 Methods for treating SARS CoV-2 infections GILEAD SCIENCES, INC. (US) 2023-05-30 US disclosed
US-20230125751-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2023-04-27 US disclosed
US-20230125751-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2023-04-27 US disclosed
WO-2022098371-A1 PRODRUGS OF 1'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGUES FOR ANTIVIRAL TREATMENT YAN MATTHEW (US) 2022-05-12 WO disclosed
WO-2021154687-A1 METHODS FOR TREATING SARS COV-2 INFECTIONS GILEAD SCIENCES, INC. (US) 2021-08-05 WO disclosed
US-20210061806-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2021-03-04 US disclosed
EP-3785717-A1 METHODS FOR TREATING CORONAVIRIDAE INFECTIONS Gilead Sciences, Inc. (US) 2021-03-03 EP disclosed
US-10695361-B2 Methods for treating arenaviridae and coronaviridae virus infections GILEAD SCIENCES, INC. (US) 2020-06-30 US disclosed
EP-3539546-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS Gilead Sciences, Inc. (US) 2019-09-18 EP disclosed
US-20070078081-A1 Antiviral compounds GILEAD SCIENCES, INC. 2007-04-05 US disclosed
US-20070072809-A1 Antiviral compounds GILEAD SCIENCES, INC. 2007-03-29 US disclosed
WO-2006110157-A9 NUCLEOSIDE PHOSPHONATE CONJUGATES AS ANTI HIV AGENTS GILEAD SCIENCES INC (US) 2007-03-08 WO disclosed
US-20070049754-A1 phosphorus substituted viricides such as ethyl (2S)-2-[[[(2R,5R)-5-(6-aminopurin-9-yl)-4-fluoro-2,5-dihydrofuran-2-yl]oxymethyl-phenoxyphosphoryl]amino]propanoate, used for treating or reducing a risk of human immunodeficiency virus (HIV) infection in a patient that may be exposed to HIV GILEAD SCIENCES, INC. 2007-03-01 US disclosed
US-20070027113-A1 Purine nucleoside phosphorylase inhibitory phosphonate compounds GILEAD SCIENCES, INC. 2007-02-01 US disclosed
US-20070027113-A1 Purine nucleoside phosphorylase inhibitory phosphonate compounds GILEAD SCIENCES, INC. 2007-02-01 US disclosed
WO-2007014352-A2 ANTIVIRAL PHOSPHONATE CONJUGATES FOR INHIBITION OF HIV GILEAD SCIENCES, INC. (US) 2007-02-01 WO disclosed
US-20070027114-A1 Phosphonate analogs of antimetabolites GILEAD SCIENCES INC. 2007-02-01 US disclosed
US-20070027116-A1 Therapeutic phosphonate derivatives GILEAD SCIENCES, INC. 2007-02-01 US disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070049754-A1 phosphorus substituted viricides such as ethyl (2S)-2-[[[(2R,5R)-5-(6-aminopurin-9-yl)-4-fluoro-2,5-dihydrofuran-2-yl]oxymethyl-phenoxyphosphoryl]amino]propanoate, used for treating or reducing a risk of human immunodeficiency virus (HIV) infection in a patient that may be exposed to HIV INPP5D, INPPL1, MTAP TSHR 4831/4885HSD17B10 4027/4885MEN1 4683/4885
US-20210061806-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS PNP, RPIA, HPRT1 TSHR 3767/4885HSD17B10 3590/4885MEN1 3156/4885
US-20070072809-A1 Antiviral compounds MAVS, EIF2AK2, ZC3HAV1 TSHR 4829/4885HSD17B10 2778/4885MEN1 4774/4885
US-10695361-B2 Methods for treating arenaviridae and coronaviridae virus infections ACE, PNP, ACE2 TSHR 4652/4885HSD17B10 1313/4885MEN1 4132/4885
US-20070027116-A1 Therapeutic phosphonate derivatives PPP5C, PPP3CA, PPP4R3A TSHR 3549/4885HSD17B10 3814/4885MEN1 2037/4885
US-20230125751-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS PNP, RPIA, HPRT1 TSHR 3767/4885HSD17B10 3590/4885MEN1 3156/4885
US-20070078081-A1 Antiviral compounds MAVS, EIF2AK2, ZC3HAV1 TSHR 4825/4885HSD17B10 2717/4885MEN1 4777/4885
US-20070027114-A1 Phosphonate analogs of antimetabolites TYMP, PHOSPHO1, PHPT1 TSHR 2471/4885HSD17B10 4069/4885MEN1 208/4885
US-11660307-B2 Methods for treating SARS CoV-2 infections ACE2, ACE, PNP TSHR 4227/4885HSD17B10 672/4885MEN1 3432/4885
US-20230346812-A1 METHODS FOR TREATING SARS COV-2 INFECTIONS ACE2, ACE, PNP TSHR 4227/4885HSD17B10 672/4885MEN1 3432/4885
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 TSHR 4782/4885HSD17B10 1703/4885MEN1 3990/4885
US-20070027113-A1 Purine nucleoside phosphorylase inhibitory phosphonate compounds PNP, TYMP, MTAP TSHR 4517/4885HSD17B10 2868/4885MEN1 3116/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.