SCHEMBL7918643

SCHEMBL7918643

C=CCOc1cccc(CCOC(=O)C(=C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
GAA P10253 2/20 0.41
BCHE P06276 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALOX5 P09917 1/20 0.40
TDP1 Q9NUW8 2/20 0.40

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
SCHEMBL7924216 0.87 KDM4E (0.48) KDM4ENPC1RAB9AADRB2ADRB1
SCHEMBL7924912 0.84 POLB (0.49) NPC1RAB9AADRB2ADRB1ADRB3
SCHEMBL7192139 0.83 MTNR1A (0.53) ALOX5MTNR1A
SCHEMBL22600438 0.81 POLB (0.46) NPC1RAB9AADRB2ADRB1ADRB3
SCHEMBL31567618 0.81 FDFT1 (0.47) TDP1
SCHEMBL28857335 0.81 PPARG (0.47) TDP1POLBAPEX1HTTPPARG
SCHEMBL17036772 0.79 TDP1 (0.46) TDP1POLBAPEX1HTTPPARG
SCHEMBL7924946 0.79 GAA (0.45) KDM4ENPC1RAB9AADRB2ADRB1
SCHEMBL65346 0.78 TDP1 (0.52) KDM4EALDH1A1TDP1POLBAPEX1
SCHEMBL723458 0.78 BCHE (0.53) KDM4ENPC1RAB9AGAABCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6231714-B1 BONDING PAIR OF SUBSTRATES LOCTITE CORPORATION 2001-05-15 US claimed
WO-2000032550-A1 ALLYLIC PHENYL ETHER (METH)ACRYLATE COMPOSITIONS AND NOVEL ALLYLIC PHENYL ETHER (METH)ACRYLATE MONOMERS LOCTITE CORPORATION (US) 2000-06-08 WO claimed
US-6231714-B1 BONDING PAIR OF SUBSTRATES LOCTITE CORPORATION 2001-05-15 US disclosed
WO-2000032550-A1 ALLYLIC PHENYL ETHER (METH)ACRYLATE COMPOSITIONS AND NOVEL ALLYLIC PHENYL ETHER (METH)ACRYLATE MONOMERS LOCTITE CORPORATION (US) 2000-06-08 WO disclosed