SCHEMBL8974002

SCHEMBL8974002

Cc1ccc2[nH]c(C(C)c3ccccc3C)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.46
KDM4E B2RXH2 2/20 0.44
LMNA P02545 2/20 0.44
HSD17B10 Q99714 1/20 0.44
HTT P42858 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
USP2 O75604 1/20 0.43
MLKL Q8NB16 3/20 0.43
CASR P41180 1/20 0.40
KMT2A Q03164 4/20 0.38
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
ALPL P05186 2/20 0.38
ALPI P09923 2/20 0.38
ALPG P10696 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
MEN1 O00255 2/20 0.38
CYP2D6 P10635 1/20 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
SCHEMBL8957989 0.85 ALDH1A1 (0.53) KDM4ELMNAHSD17B10HTTALDH1A1
SCHEMBL8974234 0.82 HTT (0.41) CYP1A2KDM4ELMNAHSD17B10HTT
SCHEMBL2757079 0.78 KDM4E (0.59) CYP1A2KDM4ELMNAHSD17B10HTT
SCHEMBL4573758 0.75 CYP1A2 (0.53) CYP1A2KDM4ELMNAHSD17B10HTT
SCHEMBL18689828 0.75 MLKL (0.49) CYP1A2KDM4ELMNAHSD17B10HTT
SCHEMBL9867044 0.73 ALDH1A1 (0.75) CYP1A2KDM4ELMNAHSD17B10HTT
SCHEMBL9676734 0.73 KDM4E (0.40) CYP1A2KDM4ELMNAHSD17B10HTT
SCHEMBL11141959 0.73 KDM4E (0.39) KDM4ELMNAHSD17B10ALDH1A1HPGD
SCHEMBL12727236 0.73 CYP1A2 (0.50) CYP1A2KDM4ELMNAHSD17B10HTT
SCHEMBL18259723 0.72 MLKL (0.69) CYP1A2KDM4ELMNAHSD17B10HTT

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
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 claimed
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