SCHEMBL19244201

SCHEMBL19244201

CCOc1ccc(/C=C/C(=O)OC(C)CC)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.63
TAS1R1 Q7RTX1 1/20 0.63
MAPT P10636 4/20 0.56
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 2/20 0.56
KMT2A Q03164 2/20 0.56
HTT P42858 1/20 0.56
MAOB P27338 9/20 0.55
ABCG2 Q9UNQ0 1/20 0.55
TP53 P04637 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MAOA P21397 1/20 0.52
SLC5A1 P13866 1/20 0.52
SLC5A2 P31639 1/20 0.52
CA12 O43570 1/20 0.51
AKR1B10 O60218 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51

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
SCHEMBL19244202 1.00 TAS1R3 (0.63) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL19244353 0.90 ABCG2 (0.55) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL19244455 0.90 ABCG2 (0.55) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL19244211 0.88 HDAC1 (0.52) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL19244435 0.88 TDP1 (0.60) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL14356145 0.88 TDP1 (0.60) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL19244210 0.88 HDAC1 (0.52) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL19244409 0.88 CA12 (0.67) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL1768686 0.88 CA12 (0.67) TAS1R3TAS1R1MAPTNPC1RAB9A
SCHEMBL13278166 0.88 NPC1 (0.53) TAS1R3TAS1R1MAPTNPC1RAB9A

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
EP-3208301-B1 RESIN COMPOSITION AND OPTICAL COMPENSATION FILM USING SAME TOSOH CORP (JP) 2019-04-03 EP disclosed
US-10126478-B2 Resin composition and optical compensation film using same TOSOH CORPORATION (JP) 2018-11-13 US disclosed
US-20170242174-A1 RESIN COMPOSITION AND OPTICAL COMPENSATION FILM USING SAME TOSOH CORPORATION (JP) 2017-08-24 US disclosed
EP-3208301-A1 RESIN COMPOSITION AND OPTICAL COMPENSATION FILM USING SAME Tosoh Corporation (JP) 2017-08-23 EP disclosed