SCHEMBL7477638

SCHEMBL7477638

COc1cccc2c1[nH]c(=O)n2-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.61
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 4/20 0.51
HPGD P15428 3/20 0.51
HSD17B10 Q99714 2/20 0.51
SLC2A1 P11166 1/20 0.47
SLC2A3 P11169 1/20 0.47
NTRK1 P04629 3/20 0.47
IGF1R P08069 3/20 0.47
FGFR1 P11362 3/20 0.47
NTRK2 Q16620 3/20 0.47
NQO2 P16083 1/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 2/20 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
SCHEMBL9118532 0.85 DAO (0.61) DAOALDH1A1KDM4EHPGDHSD17B10
SCHEMBL194512 0.78 DAO (0.69) DAOALDH1A1KDM4EHPGDNQO2
SCHEMBL5710156 0.76 L3MBTL1 (0.45) ALDH1A1KDM4EHSD17B10NTRK1IGF1R
SCHEMBL28905782 0.76 TSHR (0.49) DAOALDH1A1KDM4EHSD17B10NTRK1
SCHEMBL4716991 0.76 DAO (0.58) DAOKDM4EHSD17B10NTRK1IGF1R
SCHEMBL31597601 0.74 CA12 (0.72) ALDH1A1KDM4EHPGDHSD17B10CA12
SCHEMBL12792523 0.74 DAO (0.63) DAOALDH1A1KDM4EHPGDNQO2
SCHEMBL7552092 0.72 DAO (0.57) DAOALDH1A1KDM4EHPGDCA12
SCHEMBL9836581 0.70 MAT2A (0.61) KDM4ENTRK1IGF1RFGFR1NTRK2
SCHEMBL25613278 0.70 KDM4E (0.55) KDM4EMEN1KMT2ALMNAMAPT

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-1998004546-A1 BENZIMIDAZOLE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTICAL USES THEREOF SYNTHELABO (FR) 1998-02-05 WO disclosed