SCHEMBL8974447

SCHEMBL8974447

CCc1ccc2nc(Cc3ccccc3)[nH]c2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.67
PKM P14618 2/20 0.67
TSHR P16473 1/20 0.67
MAPT P10636 2/20 0.65
KDM4E B2RXH2 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
GRIN1 Q05586 9/20 0.60
GRIN2B Q13224 9/20 0.60
RIPK1 Q13546 1/20 0.59
CYP1A2 P05177 1/20 0.56
POLB P06746 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
NPC1 O15118 1/20 0.54
LMNA P02545 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
EGFR P00533 1/20 0.52

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
SCHEMBL8974435 0.88 GAA (0.64) GAAPKMTSHRMAPTKDM4E
SCHEMBL8973979 0.87 RAB9A (0.68) GAAPKMTSHRMAPTKDM4E
SCHEMBL8973998 0.84 POLB (0.71) GAAPKMTSHRMAPTKDM4E
SCHEMBL868184 0.84 DDAH1 (0.59) GAAPKMTSHRMAPTKDM4E
SCHEMBL8620318 0.84 GAA (0.58) GAAPKMTSHRMAPTKDM4E
SCHEMBL4164831 0.80 EGFR (0.76) GAAPKMTSHRMAPTKDM4E
SCHEMBL8557293 0.80 MAPT (0.97) GAAPKMTSHRMAPTKDM4E
SCHEMBL8596529 0.80 KDM4E (0.55) GAAPKMTSHRMAPTKDM4E
SCHEMBL15947594 0.80 TDP1 (0.61) GAAPKMTSHRTDP1CYP1A2
SCHEMBL7916738 0.79 GRIN1 (0.85) GAAPKMTSHRMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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