SCHEMBL9752984

SCHEMBL9752984

CCOC(=O)c1c(-c2ccc(F)cc2)nn2c(SC)ccc2c1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
KDM4E B2RXH2 7/20 0.41
HPGD P15428 6/20 0.41
LMNA P02545 2/20 0.41
PRKCZ Q05513 1/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 3/20 0.40
NPC1 O15118 2/20 0.40
PKM P14618 2/20 0.40
RAB9A P51151 2/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 2/20 0.39
ALOX15 P16050 1/20 0.39
GRM6 O15303 1/20 0.38
ALOX5 P09917 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38

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
SCHEMBL9752976 0.88 KDM4E (0.43) ALDH1A1KDM4EHPGDLMNAPRKCZ
SCHEMBL9753107 0.86 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDLMNAPRKCZ
SCHEMBL9753110 0.84 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDLMNAPRKCZ
SCHEMBL5095533 0.84 GCGR (0.42) ALDH1A1KDM4EHPGDPRKCZGAA
SCHEMBL9753651 0.82 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDLMNAPRKCZ
SCHEMBL9752865 0.78 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDLMNAPRKCZ
SCHEMBL9753720 0.78 GCGR (0.38) TGFBR1
SCHEMBL9752936 0.78 ALDH1A1 (0.44) ALDH1A1KDM4EHPGDLMNAPRKCZ
SCHEMBL9752966 0.76 DGAT1 (0.41) ALDH1A1KDM4EHPGDLMNAPRKCZ
SCHEMBL9752970 0.76 KDM5B (0.34) ALDH1A1KMT2APTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991018903-A1 PYRROLOPYRIDAZINE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-12-12 WO disclosed