SCHEMBL5857396

SCHEMBL5857396

COC(=O)CNC(=O)c1cccs1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.64
GAA P10253 1/20 0.63
KDM4E B2RXH2 1/20 0.60
HPGD P15428 3/20 0.58
ALDH1A1 P00352 1/20 0.58
SMN1; SMN2 Q16637 4/20 0.57
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
TP53 P04637 1/20 0.57
HDAC1 Q13547 1/20 0.55
POLB P06746 1/20 0.54
ALOX15 P16050 1/20 0.54

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
SCHEMBL1222336 0.86 ALDH1A1 (0.61) TSHRGAAKDM4EHPGDALDH1A1
SCHEMBL12491925 0.85 GAA (0.70) TSHRGAAKDM4EHPGDALDH1A1
SCHEMBL7394648 0.84 KDM4E (0.66) TSHRGAAKDM4EHPGDALDH1A1
SCHEMBL5855304 0.83 KDM4E (0.64) TSHRGAAKDM4EHPGDALDH1A1
SCHEMBL3814103 0.81 GAA (0.69) TSHRGAAKDM4EHPGDALDH1A1
SCHEMBL1222245 0.81 KDM4E (0.66) TSHRGAAKDM4EHPGDALDH1A1
SCHEMBL7503385 0.80 KDM4E (0.70) TSHRGAAKDM4EHPGDALDH1A1
SCHEMBL21479628 0.80 KDM4E (0.60) TSHRGAAKDM4EHPGDALDH1A1
SCHEMBL15247363 0.80 KDM4E (0.60) TSHRGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL2330242 0.80 GAA (0.82) TSHRGAAKDM4EHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144906-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-12-05 US disclosed
US-7030143-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-18 US disclosed
US-7022723-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-04 US disclosed
EP-1634876-A2 Heterocyclic compounds for the treatment of hyperlipidemia agents Nippon Shinyaku Co., Ltd. (JP) 2006-03-15 EP disclosed
US-6998412-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-02-14 US disclosed
CN-1238347-C Heterocyclic derivatives NIPPON SHINYAKU CO LTD (JP) 2006-01-25 CN disclosed
US-20050009892-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2005-01-13 US disclosed
US-20050009785-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2005-01-13 US disclosed
US-20040162325-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2004-08-19 US disclosed
US-20030166697-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2003-09-04 US disclosed
CN-1430612-A Hete rocyclic derivatives NIPPON SHINYAKU CO LTD (JP) 2003-07-16 CN disclosed
EP-1295875-A1 HETEROCYCLIC COMPOUNDS Nippon Shinyaku Co., Ltd. (JP) 2003-03-26 EP disclosed
EP-0421365-B1 Tetrazoleacetic acid derivatives having aldose reductase inhibitory activity WAKAMOTO PHARMA CO LTD (JP) 1997-03-05 EP disclosed
US-RE35321-E ANTIDIABETIC AGENT WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1996-08-27 US disclosed
US-5068239-A Antidiabetic agent WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1991-11-26 US disclosed
EP-0421365-A2 Tetrazoleacetic acid derivatives having aldose reductase inhibitory activity Wakamoto Pharmaceutical Co., Ltd. (JP) 1991-04-10 EP disclosed
US-4419363-A ADRENERGIC BLOCKING AGENTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-12-06 US disclosed
US-4346111-A CARDIOVASCULAR DISORDERS, HYPOTENSIVE AGENTS, ADRENERGIC BLOCKING AGENTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1982-08-24 US disclosed
US-4318921-A HYPOTENSIVE AGENTS; ADRENERGIC BLOCKING AGENTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1982-03-09 US disclosed
US-4211878-A ADRENERGIC BLOCKING AGENTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-07-08 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-20050009785-A1 Heterocyclic compounds LIPC, GPR119, APOB TSHR 1666/4885GAA 565/4885KDM4E 1600/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE TSHR 2487/4885GAA 804/4885KDM4E 1141/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC TSHR 2672/4885GAA 780/4885KDM4E 1321/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC TSHR 2672/4885GAA 780/4885KDM4E 1321/4885

“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.