SCHEMBL9715772

SCHEMBL9715772

C=C(C(=C)c1ccccc1OC)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.53
NPC1 O15118 3/20 0.53
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
ATM Q13315 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KCNK3 O14649 1/20 0.45
KCNK9 Q9NPC2 1/20 0.45
CTSD P07339 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL9715716 0.86 KMT2A (0.46) RAB9ANPC1ALDH1A1MAPTTDP1
SCHEMBL28558451 0.82 RAB9A (0.54) RAB9ANPC1ALDH1A1MAPTSLC6A3
SCHEMBL7288918 0.81 STAT3 (0.54) RAB9ANPC1ALDH1A1MAPTKCNK3
SCHEMBL30364459 0.81 STAT3 (0.54) RAB9ANPC1ALDH1A1MAPTKCNK3
SCHEMBL9715756 0.80 MEN1 (0.52) RAB9AALDH1A1MAPTATMTDP1
SCHEMBL13539020 0.79 CA1 (0.52) RAB9ANPC1ALDH1A1KCNK3KCNK9
SCHEMBL3277622 0.79 CA1 (0.57) RAB9ANPC1KCNK3KCNK9CTSD
SCHEMBL7952 0.78 RAB9A (0.58) RAB9ANPC1ALDH1A1MAPTSLC6A3
SCHEMBL9101 0.78 RAB9A (0.58) RAB9ANPC1ALDH1A1MAPTSLC6A3
SCHEMBL27134760 0.77 CA1 (0.44) RAB9ANPC1MAPTKCNK3KCNK9

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