SCHEMBL4391901

SCHEMBL4391901

CCCc1cc(O)ccc1CN

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TYR P14679 5/20 0.48
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX5 P09917 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ESR1 P03372 4/20 0.43
ESR2 Q92731 4/20 0.43
HSD17B3 P37058 1/20 0.42
PTPN1 P18031 1/20 0.41
PTPN11 Q06124 1/20 0.41
PRKCI P41743 1/20 0.37
ABAT P80404 1/20 0.37
ENPP2 Q13822 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
SCHEMBL10825810 0.87 TYR (0.55) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL31613067 0.87 TYR (0.55) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL1050392 0.86 TYR (0.47) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10822716 0.83 TYR (0.52) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL9156290 0.83 TYR (0.52) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL4387625 0.83 TYR (0.42) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL5382155 0.82 TYR (0.55) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL18044778 0.80 TYR (0.48) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL4563615 0.80 TYR (0.69) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL27537794 0.80 TYR (0.69) TYRMEN1TP53CYP3A4ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227390-B2 Binder resin for friction material, binder resin composition for friction material, composite material for friction material containing the same, friction material and production method thereof AKEBONO BRAKE INDUSTRY CO., LTD. (JP) 2012-07-24 US disclosed
US-20090137434-A1 BINDER RESIN FOR FRICTION MATERIAL, BINDER RESIN COMPOSITION FOR FRICTION MATERIAL, COMPOSITE MATERIAL FOR FRICTION MATERIAL CONTAINING THE SAME, FRICTION MATERIAL AND PRODUCTION METHOD THEREOF AKEBONO BRAKE INDUSTRY CO., LTD (JP) 2009-05-28 US disclosed