SCHEMBL9119172

SCHEMBL9119172

CCCCCCC=CCc1cc(O)c2ccccc2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 2/20 0.43
HSD17B10 Q99714 2/20 0.43
CES1 P23141 2/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GLA P06280 1/20 0.43
CYP3A4 P08684 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
DAGLA Q9Y4D2 1/20 0.43
EPHX2 P34913 2/20 0.41
CYP2D6 P10635 1/20 0.41
MMP2 P08253 2/20 0.41
F7 P08709 2/20 0.41
F3 P13726 2/20 0.41
ALOX15 P16050 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
SCHEMBL16431027 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL16431209 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL29368070 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL16433240 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL16432811 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL2126335 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL16431614 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL170164 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL16431372 0.81 KDM4E (0.54) KDM4EMAPTHSD17B10USP2ALDH1A1
SCHEMBL9119169 0.81 MAPT (0.44) FAAHKDM4EMAPTHSD17B10CES1

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
WO-1995028929-A1 AMINOLINE-N-OXIDE ANTIMICROBIALS FOR USE AGAINST H. PYLORI INFECTIONS RPMS TECHNOLOGY LIMITED (GB) 1995-11-02 WO disclosed
WO-1995028929-A1 AMINOLINE-N-OXIDE ANTIMICROBIALS FOR USE AGAINST H. PYLORI INFECTIONS RPMS TECHNOLOGY LIMITED (GB) 1995-11-02 WO disclosed