SCHEMBL11158332

SCHEMBL11158332

CCn1nc(NC(C)=O)c2sc3cc(C)ccc3c21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 1/20 0.43
▸ DYRK1A Q13627 2/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ APOBEC3A P31941 1/20 0.41
▸ APOBEC3G Q9HC16 1/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ TP53 P04637 1/20 0.40
▸ KDM4E B2RXH2 6/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ CASP1 P29466 2/20 0.39
▸ CASP7 P55210 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TSHR P16473 1/20 0.39

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
SCHEMBL11145581 0.84 MEN1 (0.52) DYRK1AKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL11149542 0.68 PARP14 (0.47) DYRK1AKMT2AMEN1L3MBTL1SMN1; SMN2
SCHEMBL11144388 0.67 MEN1 (0.40) DYRK1AKMT2AMEN1L3MBTL1TP53
SCHEMBL1690197 0.62 MEN1 (0.48) DYRK1AKMT2AMEN1KDM4EHSD17B10
SCHEMBL3123994 0.61 BCL2L1 (0.47) SMN1; SMN2KDM4EHSD17B10MAPTLMNA
SCHEMBL11146665 0.61 MAPT (0.38) SMN1; SMN2TP53KDM4EHSD17B10MAPT
SCHEMBL12412960 0.60 MCL1 (0.38) SMN1; SMN2TP53KDM4EHSD17B10MAPT
SCHEMBL12412980 0.60 MCL1 (0.38) KMT2ASMN1; SMN2TP53KDM4EHSD17B10
SCHEMBL18252668 0.60 BCL2L1 (0.46) SMN1; SMN2KDM4EMAPTLMNAALDH1A1
SCHEMBL15497379 0.60 BCL2L1 (0.46) SMN1; SMN2KDM4EMAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0005357-B1 N-(BENZOTHIENOPYRAZOL)-AMIDES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-02-09 — — EP disclosed
EP-0005357-A1 N-(Benzothienopyrazol)-amides and pharmaceutical compositions containing them E.I. DU PONT DE NEMOURS AND COMPANY (US) 1979-11-14 — — EP disclosed
US-4140785-A N-(benzothienopyrazol)amide antirhinoviral agents E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-02-20 — — US disclosed
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