SCHEMBL9752966

SCHEMBL9752966

CCOC(=O)c1c(-c2ccc(F)cc2)nn2c(Br)cc(Br)c2c1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.41
SOAT1 P35610 1/20 0.41
ALDH1A1 P00352 6/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CHRNA7 P36544 1/20 0.40
KDM4E B2RXH2 5/20 0.40
HPGD P15428 4/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
MAPT P10636 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 1/20 0.39
TGFBR1 P36897 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
HSD17B10 Q99714 1/20 0.38
GRM6 O15303 1/20 0.38
PRKCZ Q05513 1/20 0.38
MEN1 O00255 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
SCHEMBL9752981 0.90 DGAT1 (0.40) DGAT1SOAT1ALDH1A1L3MBTL1CHRNA7
SCHEMBL9753480 0.84 GCGR (0.42) DGAT1SOAT1ALDH1A1L3MBTL1CHRNA7
SCHEMBL9753107 0.84 ALDH1A1 (0.43) DGAT1SOAT1ALDH1A1L3MBTL1KDM4E
SCHEMBL9752936 0.84 ALDH1A1 (0.44) DGAT1SOAT1ALDH1A1L3MBTL1CHRNA7
SCHEMBL9753066 0.80 DGAT1 (0.46) DGAT1SOAT1ALDH1A1L3MBTL1KDM4E
SCHEMBL9752976 0.79 KDM4E (0.43) DGAT1SOAT1ALDH1A1L3MBTL1KDM4E
SCHEMBL9753668 0.77 GRM6 (0.41) DGAT1SOAT1ALDH1A1L3MBTL1CHRNA7
SCHEMBL9753110 0.76 ALDH1A1 (0.41) DGAT1SOAT1ALDH1A1L3MBTL1KDM4E
SCHEMBL9752984 0.76 ALDH1A1 (0.41) DGAT1SOAT1ALDH1A1L3MBTL1KDM4E
SCHEMBL9753031 0.75 PPP1CA (0.37) KDM4EMEN1KMT2A

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