SCHEMBL11150491

SCHEMBL11150491

CC(C)C(=O)Nc1nn(C)c2c1sc1cc(Cl)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ CASP7 P55210 2/20 0.41
▸ MAPT P10636 7/20 0.40
▸ KDM4E B2RXH2 6/20 0.40
▸ KMT2A Q03164 6/20 0.39
▸ NPC1 O15118 5/20 0.38
▸ RAB9A P51151 5/20 0.38
▸ ALDH1A1 P00352 6/20 0.38
▸ HTT P42858 3/20 0.38
▸ RXFP1 Q9HBX9 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.37
▸ HPGD P15428 5/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ CASP3 P42574 1/20 0.36
▸ SENP7 Q9BQF6 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
SCHEMBL11148719 0.78 KDM4E (0.43) HSD17B10CASP1CASP7MAPTKDM4E
SCHEMBL11149960 0.77 MAPT (0.40) HSD17B10CASP1CASP7MAPTKDM4E
SCHEMBL11145581 0.74 MEN1 (0.52) HSD17B10CASP1CASP7MAPTKDM4E
SCHEMBL11149542 0.69 PARP14 (0.47) HSD17B10CASP1CASP7MAPTKDM4E
SCHEMBL11144388 0.69 MEN1 (0.40) HSD17B10CASP1CASP7MAPTKDM4E
SCHEMBL16006510 0.69 KDM4E (0.45) HSD17B10CASP1CASP7MAPTKDM4E
SCHEMBL11148572 0.68 BTK (0.43) MAPTKMT2ANPC1RAB9AALDH1A1
SCHEMBL11153753 0.67 MAPT (0.43) HSD17B10CASP1CASP7MAPTKDM4E
SCHEMBL11216887 0.67 ALDH1A1 (0.48) MAPTKDM4EKMT2ANPC1RAB9A
SCHEMBL11155492 0.67 TP53 (0.41) HSD17B10CASP1CASP7MAPTKDM4E

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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