SCHEMBL19244199

SCHEMBL19244199

CCCCC(CC)COC(=O)/C=C/c1ccccc1OCC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.57
ALDH1A1 P00352 9/20 0.52
CYP3A4 P08684 3/20 0.52
CA2 P00918 1/20 0.52
TSHR P16473 3/20 0.49
LMNA P02545 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
MAPT P10636 3/20 0.47
ATM Q13315 2/20 0.47
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
MAPK1 P28482 4/20 0.43
AR P10275 1/20 0.43
KDM4E B2RXH2 3/20 0.42
HPGD P15428 3/20 0.42
HSD17B10 Q99714 1/20 0.42
KMT2A Q03164 1/20 0.39
NFE2L2 Q16236 1/20 0.39
NPC1 O15118 1/20 0.38

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
SCHEMBL19244200 1.00 TDP1 (0.57) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL19244254 0.94 TDP1 (0.61) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL19244481 0.93 TDP1 (0.57) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL6291897 0.90 TDP1 (0.65) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL382365 0.90 TDP1 (0.65) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL19244381 0.88 TDP1 (0.56) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL19244380 0.88 TDP1 (0.56) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL19244289 0.87 TDP1 (0.55) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL19244402 0.87 TDP1 (0.55) TDP1ALDH1A1CYP3A4CA2TSHR
SCHEMBL19244403 0.87 TDP1 (0.55) TDP1ALDH1A1CYP3A4CA2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106795327-B Resin composition and optical compensation film using the same 东曹株式会社 2019-08-30 CN disclosed
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