SCHEMBL9753066

SCHEMBL9753066

CCOC(=O)c1c(-c2ccc(F)cc2)nn2c(C)cc(-c3ccccc3)c2c1C(C)C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 11/20 0.46
SOAT1 P35610 8/20 0.46
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 4/20 0.46
HPGD P15428 3/20 0.46
GAA P10253 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPT P10636 2/20 0.45
TP53 P04637 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL9752936 0.88 ALDH1A1 (0.44) DGAT1SOAT1ALDH1A1KDM4EHPGD
SCHEMBL9752978 0.81 DHODH (0.41) SMN1; SMN2MEN1KMT2A
SCHEMBL9752966 0.80 DGAT1 (0.41) DGAT1SOAT1ALDH1A1KDM4EHPGD
SCHEMBL9752976 0.80 KDM4E (0.43) DGAT1SOAT1ALDH1A1KDM4EHPGD
SCHEMBL9752981 0.79 DGAT1 (0.40) DGAT1SOAT1ALDH1A1KDM4EHPGD
SCHEMBL9752959 0.78 POLB (0.38) ALDH1A1MEN1KMT2A
SCHEMBL27352605 0.76 KDM4E (0.38) ALDH1A1KDM4EHPGDSMN1; SMN2LMNA
SCHEMBL9753107 0.76 ALDH1A1 (0.43) DGAT1SOAT1ALDH1A1KDM4EHPGD
SCHEMBL9831189 0.76 PDE4D (0.51) ALDH1A1KDM4EHPGDGAASMN1; SMN2
SCHEMBL9753668 0.75 GRM6 (0.41) DGAT1SOAT1ALDH1A1KDM4EHPGD

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