SCHEMBL4387609

SCHEMBL4387609

CCCOc1cc(O)ccc1CCN

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.46
CNR1 P21554 8/20 0.46
HTR1A P08908 1/20 0.43
HTR1B P28222 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
CASP1 P29466 1/20 0.42
HTT P42858 1/20 0.42
CASP7 P55210 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
TYR P14679 1/20 0.41
LTA4H P09960 1/20 0.41

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
SCHEMBL8139885 0.88 CNR2 (0.49) CNR2CNR1MEN1TP53MAPT
SCHEMBL1049677 0.87 HTR2C (0.41) CNR2CNR1HTR1AHTR1BMAPT
SCHEMBL4399572 0.87 CSNK2A1 (0.45) CNR2CNR1KDM4EMEN1USP2
SCHEMBL3881130 0.81 TAAR1 (0.42) HTR1AHTR1BMAPT
SCHEMBL20563650 0.81 SMN1; SMN2 (0.50) HTR1AHTR1BKDM4EMEN1USP2
SCHEMBL28282874 0.80 CNR2 (0.45) CNR2CNR1MEN1ALDH1A1TP53
SCHEMBL4363956 0.80 MAOB (0.57)
SCHEMBL2442358 0.79 MAOB (0.55) KDM4EMEN1USP2ALDH1A1TP53
SCHEMBL30118840 0.79 MAOB (0.55) KDM4EMEN1USP2ALDH1A1TP53
SCHEMBL9698367 0.77 CNR2 (0.62) CNR2CNR1MEN1TP53MAPT

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