SCHEMBL8961346

SCHEMBL8961346

CCCc1cc(C)c(Oc2cccc(N)c2)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
POLB P06746 1/20 0.49
HSP90AA1 P07900 1/20 0.49
CYP3A4 P08684 2/20 0.47
TP53 P04637 1/20 0.47
MAOB P27338 2/20 0.46
TSHR P16473 1/20 0.45
ALDH1A1 P00352 4/20 0.43
APP P05067 1/20 0.38
FFAR1 O14842 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.36
ATM Q13315 1/20 0.36
MEN1 O00255 1/20 0.36
MITF O75030 1/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NLRP1 Q9C000 1/20 0.36
NOD2 Q9HC29 1/20 0.36

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
SCHEMBL8578456 0.83 ALDH1A1 (0.46) MAPTPOLBCYP3A4TSHRALDH1A1
SCHEMBL8961374 0.82 CYP3A4 (0.45) MAPTPOLBHSP90AA1CYP3A4TP53
SCHEMBL8364512 0.81 MAOB (0.56) MAPTPOLBHSP90AA1CYP3A4TP53
SCHEMBL31180032 0.80 MAOB (0.60) MAPTPOLBHSP90AA1CYP3A4TP53
SCHEMBL5604240 0.80 MAPT (0.58) MAPTPOLBHSP90AA1CYP3A4TP53
SCHEMBL3151082 0.80 MAOB (0.59) MAPTPOLBHSP90AA1CYP3A4TP53
SCHEMBL9770081 0.78 MAOB (0.49) MAPTPOLBHSP90AA1CYP3A4TP53
SCHEMBL6934775 0.76 MAPT (0.53) MAPTPOLBHSP90AA1CYP3A4TP53
SCHEMBL21496115 0.76 ALDH1A1 (0.48) MAPTTP53TSHRALDH1A1FFAR1
SCHEMBL2993851 0.75 ALDH1A1 (0.52) MAPTPOLBHSP90AA1CYP3A4TP53

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
US-5514748-A POLYMER FOR SLIDING CONTAINING PHENOLIC RESINS AND LUBRICANTS WITH POLYIMIDES MITSUI TOATSU CHEMICALS, INC. (JP) 1996-05-07 US disclosed