SCHEMBL13670306

SCHEMBL13670306

CCc1ccc(C(=O)c2ccc(Oc3ccc4cc(Oc5ccc(C(=O)c6ccc(C)cc6)cc5)ccc4c3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.48
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
MAPK14 Q16539 1/20 0.47
SRD5A2 P31213 5/20 0.47
MMP13 P45452 2/20 0.46
PTGS2 P35354 1/20 0.46
HTT P42858 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
CHRNA7 P36544 1/20 0.44
MAPT P10636 1/20 0.44
CHEK2 O96017 1/20 0.44
MAOB P27338 1/20 0.43

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
SCHEMBL13670333 0.97 P2RY14 (0.46) P2RY14ALDH1A1LMNAMAPK14SRD5A2
SCHEMBL13670310 0.92 ALDH1A1 (0.55) P2RY14ALDH1A1LMNAMAPK14SRD5A2
SCHEMBL19339947 0.92 ALDH1A1 (0.55) P2RY14ALDH1A1LMNAMAPK14SRD5A2
SCHEMBL16995928 0.92 ALDH1A1 (0.55) P2RY14ALDH1A1LMNAMAPK14SRD5A2
SCHEMBL13670313 0.92 ALDH1A1 (0.55) P2RY14ALDH1A1LMNAMAPK14SRD5A2
SCHEMBL18661573 0.92 ALDH1A1 (0.55) P2RY14ALDH1A1LMNAMAPK14SRD5A2
SCHEMBL822846 0.89 LMNA (0.59) ALDH1A1LMNASRD5A2MMP13HTT
SCHEMBL13670325 0.88 ALDH1A1 (0.50) P2RY14ALDH1A1LMNAMAPK14SRD5A2
SCHEMBL822845 0.86 LMNA (0.55) ALDH1A1LMNASRD5A2MMP13HTT
SCHEMBL12769549 0.86 LMNA (0.55) ALDH1A1LMNASRD5A2MMP13HTT

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