SCHEMBL13670323

SCHEMBL13670323

CCc1ccc(C(=O)c2ccc(Oc3ccc(C4(c5ccc(Oc6ccc(C(=O)c7ccc(C)cc7)cc6)cc5)c5ccccc5-c5ccccc54)cc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.44
SRD5A2 P31213 6/20 0.44
ACHE P22303 1/20 0.39
MAPT P10636 2/20 0.39
P2RY14 Q15391 1/20 0.39
TP53 P04637 1/20 0.39
KIF11 P52732 1/20 0.39
MMP13 P45452 1/20 0.38
EPHX2 P34913 1/20 0.38
ALDH1A1 P00352 2/20 0.38
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.37
CHRM5 P08912 1/20 0.37

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
SCHEMBL822951 0.92 SRD5A2 (0.46) MAPK14SRD5A2MAPTKIF11MMP13
SCHEMBL13252913 0.92 SRD5A2 (0.46) MAPK14SRD5A2MAPTKIF11MMP13
SCHEMBL13663839 0.92 SRD5A2 (0.46) MAPK14SRD5A2MAPTKIF11MMP13
SCHEMBL16352320 0.90 SMN1; SMN2 (0.44) MAPK14SRD5A2MAPTTP53ALDH1A1
SCHEMBL13557148 0.90 SRD5A2 (0.49) MAPK14SRD5A2ACHEKIF11MMP13
SCHEMBL13882640 0.87 RAB9A (0.43) SRD5A2ACHEMAPTMMP13ALDH1A1
SCHEMBL9914259 0.87 RAB9A (0.43) SRD5A2ACHEMAPTMMP13ALDH1A1
SCHEMBL15760410 0.87 RAB9A (0.43) SRD5A2ACHEMAPTMMP13ALDH1A1
SCHEMBL13252917 0.87 MAPT (0.47) MAPK14SRD5A2MAPTKIF11MMP13
SCHEMBL13321950 0.87 RAB9A (0.43) SRD5A2ACHEMAPTMMP13ALDH1A1

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-20090269645-A1 POLYMER, POLYMER ELECTROLYTE AND FUEL CELL USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-29 US disclosed