SCHEMBL8973998

SCHEMBL8973998

Cc1ccc2nc(Cc3ccccc3)[nH]c2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.71
CYP1A2 P05177 1/20 0.71
CYP3A4 P08684 1/20 0.71
CYP2D6 P10635 1/20 0.71
CYP2C9 P11712 1/20 0.71
CYP2C19 P33261 1/20 0.71
GAA P10253 3/20 0.70
PKM P14618 2/20 0.70
TSHR P16473 1/20 0.70
KDM4E B2RXH2 1/20 0.68
MAPT P10636 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
KMT2A Q03164 3/20 0.66
RIPK1 Q13546 1/20 0.62
SMN1; SMN2 Q16637 2/20 0.61
RAB9A P51151 2/20 0.61
GFER P55789 2/20 0.61
LMNA P02545 1/20 0.61
HTT P42858 1/20 0.61
HIF1A Q16665 1/20 0.61

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
SCHEMBL8974004 0.88 KMT2A (0.77) POLBCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL8973995 0.87 GAA (0.68) POLBCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2952411 0.85 KMT2A (0.80) POLBCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL8974016 0.85 KMT2A (0.75) POLBCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL28642278 0.84 POLB (0.72) POLBCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL8974447 0.84 GAA (0.67) POLBCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL4164831 0.83 EGFR (0.76) CYP3A4GAAPKMTSHRKDM4E
SCHEMBL8557293 0.83 MAPT (0.97) POLBCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7916738 0.82 GRIN1 (0.85) POLBCYP1A2CYP3A4CYP2D6CYP2C9
Bendazol SCHEMBL29539948 0.81 GAA (1.00) POLBGAAPKMTSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109206372-B New application of N-cyano-N-phenyl aryl sulfonamide and method for N-aryl sulfonylation of 2-substituted benzimidazole 长沙理工大学 2021-07-27 CN disclosed
EP-0551112-B1 Benzimidazole derivative and composition for treating copper and copper alloy surfaces comprising the same MEC CO LTD (JP) 1996-04-03 EP disclosed
US-5476947-A Excellent rust preventing effect, useful as corrosion resistance protective coating in printed wiring boards MEC CO., LTD. (JP) 1995-12-19 US disclosed
US-5435860-A Corrosion resistance for printed circuits MEC CO., LTD. (JP) 1995-07-25 US disclosed
EP-0551112-A1 Benzimidazole derivative and composition for treating copper and copper alloy surfaces comprising the same MEC CO., Ltd. (JP) 1993-07-14 EP disclosed