SCHEMBL15747148

SCHEMBL15747148

CCc1ccc2c(ccc3nc(C)[nH]c32)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMS P04818 6/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
KMT2A Q03164 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
LMNA P02545 3/20 0.40
MEN1 O00255 2/20 0.40
HPGD P15428 2/20 0.40
GAA P10253 1/20 0.40
PTK2B Q14289 1/20 0.40
ELANE P08246 2/20 0.40
KIF11 P52732 1/20 0.38
RAD52 P43351 2/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 3/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL17973094 0.86 TYMS (0.38) TYMSALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL18467415 0.81 CYP1A2 (0.41) TYMSCYP1A2CYP2A6ALDH1A1SMN1; SMN2
SCHEMBL2756731 0.80 CYP1A2 (0.44) TYMSCYP1A2CYP2A6ALDH1A1KMT2A
SCHEMBL17973095 0.78 TYMS (0.54) TYMSALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL12327629 0.75 KIF11 (0.38) TYMSALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL2757174 0.75 ALDH1A1 (0.58) TYMSCYP1A2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL9514599 0.73 KDM4E (0.59) TYMSALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL15747182 0.73 CYP1A2 (0.46) TYMSCYP1A2CYP2A6ALDH1A1SMN1; SMN2
SCHEMBL10644678 0.73 TYMS (0.60) TYMSCYP1A2CYP2A6ALDH1A1SMN1; SMN2
SCHEMBL10147708 0.72 KMT2A (0.44) CYP1A2CYP2A6ALDH1A1KMT2ANPC1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9802949-B2 Fused ring compounds as hepatitis C virus inhibitors, pharmaceutical compositions and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-10-31 US disclosed
US-9416139-B2 Spiro ring compound as hepatitis C virus (HCV) inhibitor and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-08-16 US disclosed
US-9303061-B2 Spiro compounds as Hepatitis C virus inhibitors Sunshine Luke Pharma Co., Ltd. (CN) 2016-04-05 US disclosed
US-20150307509-A1 FUSED RING COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-10-29 US disclosed
US-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-08-20 US disclosed
US-20150079028-A1 Bridged Ring compounds As Hepatitis C Virus (HCV) Inhibitors And Pharmaceutical Applications Thereof SUNSHINE LAKE PHARMA CO., LTD (CN) 2015-03-19 US disclosed
US-20140147412-A1 SPIRO COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2014-05-29 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 (4 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-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS HAVCR2, SLC10A1, SORD TYMS 2394/4885CYP1A2 112/4885CYP2A6 155/4885
US-20150307509-A1 FUSED RING COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF CUL4A, GTF3C4, HAVCR2 TYMS 3742/4885CYP1A2 160/4885CYP2A6 272/4885
US-20140147412-A1 SPIRO COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS HAVCR2, SORD, SLC10A1 TYMS 1170/4885CYP1A2 97/4885CYP2A6 84/4885
US-20150079028-A1 Bridged Ring compounds As Hepatitis C Virus (HCV) Inhibitors And Pharmaceutical Applications Thereof SLC10A1, HAVCR2, UGT1A3 TYMS 3181/4885CYP1A2 70/4885CYP2A6 202/4885

“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.