SCHEMBL9715736

SCHEMBL9715736

C=C(C(=C)c1ccccc1O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.48
KDM4E B2RXH2 7/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
ALDH1A1 P00352 4/20 0.48
CA12 O43570 2/20 0.48
CA2 P00918 2/20 0.48
CA4 P22748 2/20 0.48
CA14 Q9ULX7 2/20 0.48
CA1 P00915 1/20 0.48
HMGB1 P09429 1/20 0.48
CA6 P23280 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
NAPRT Q6XQN6 1/20 0.48
MAPT P10636 4/20 0.46
CYP3A4 P08684 2/20 0.46
GSTA1 P08263 1/20 0.42
HSD17B10 Q99714 4/20 0.41
TSHR P16473 2/20 0.41
LIG1 P18858 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
SCHEMBL516298 0.81 HPGD (0.54) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL50199 0.80 CES1 (0.47) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL2113883 0.79 HPGD (0.50) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL30231535 0.77 KDM4E (0.60) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL928902 0.77 KDM4E (0.60) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL8829796 0.77 MAPT (0.46) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL4422877 0.76 HPGD (0.46) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL9715729 0.76 ALDH1A1 (0.61) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL3190837 0.75 HPGD (0.56) HPGDKDM4ESMN1; SMN2ALDH1A1CA12
SCHEMBL11773803 0.74 KMT2A (0.52) HPGDKDM4ESMN1; SMN2ALDH1A1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0311689-B1 PROCESS FOR SELECTIVELY MONOHYDROFORMYLATING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-06-10 EP disclosed
EP-0304495-B1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-05-27 EP disclosed
US-4982007-A CARBONYLATION CATALYST NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-01-01 US disclosed
US-4908473-A Reacting a (1-arylethenyl)vinylbenzene with carbon monoxide and water or alcohol in the presence of carbonylation catalyst NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-03-13 US disclosed
EP-0311689-A1 PROCESS FOR SELECTIVELY MONOHYDROFORMYLATING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-04-19 EP disclosed
EP-0304495-A1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-03-01 EP disclosed