SCHEMBL7630645

SCHEMBL7630645

CC(C)CCc1ccccc1CCC(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
SLC6A3 Q01959 1/20 0.48
DHODH Q02127 1/20 0.42
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
ALDH1A1 P00352 2/20 0.38
AOC3 Q16853 2/20 0.38
TAAR1 Q96RJ0 1/20 0.36
TSHR P16473 1/20 0.35
ESR1 P03372 2/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL31517195 1.00 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3DHODHGABRA1
SCHEMBL6681327 0.91 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3DHODHGABRA1
SCHEMBL6681332 0.89 CYP4F2 (0.44) SLC6A2SLC6A4SLC6A3DHODHGABRA1
SCHEMBL5784663 0.89 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3DHODHAOC3
SCHEMBL3047458 0.85 TAAR1 (0.56) SLC6A2SLC6A4SLC6A3DHODHALDH1A1
SCHEMBL6548109 0.85 HTR2A (0.57) SLC6A2SLC6A4SLC6A3AOC3TAAR1
SCHEMBL7637846 0.84 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3DHODHGABRA1
SCHEMBL15286071 0.84 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3DHODHGABRA1
SCHEMBL4368919 0.84 TAAR1 (0.54) SLC6A2SLC6A4SLC6A3DHODHGABRA1
SCHEMBL6681498 0.84 GABRA1 (0.41) SLC6A2SLC6A4SLC6A3DHODHGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4518764-A POLYDIALLYL TEREPHTHALATE ENDCAPPED WITH ALKLARYL HYDROCARBON OSAKA SODA CO. LTD. (JP) 1985-05-21 US claimed
CN-110072933-A Expire the tire and application thereof of resin comprising polyindene 伊士曼化工公司 2019-07-30 CN disclosed
EP-1534722-B1 RHODIUM AND IRIDIUM COMPLEXES MERCK PATENT GMBH (DE) 2017-03-22 EP disclosed
EP-1233028-A1 OPTICAL MATERIAL COMPRISING STAR-SHAPED HYDROGENATED POLYSTYRENE BLOCK COPOLYMER, PROCESS FOR PRODUCING THE SAME, AND SUBSTRATE FOR OPTICAL DISK TEIJIN LIMITED (JP) 2002-08-21 EP disclosed
US-5178951-A Thermosetting resin composition OSAKA SODA CO., LTD. (JP) 1993-01-12 US disclosed
US-5110873-A Molding materials OSAKA SODA CO., LTD. (JP) 1992-05-05 US disclosed
EP-0295347-B1 THERMOSETTING RESIN COMPOSITION Daiso Co., Ltd. (JP) 1991-08-28 EP disclosed
EP-0295347-A1 Thermosetting resin composition Daiso Co., Ltd. (JP) 1988-12-21 EP disclosed
US-4518764-A POLYDIALLYL TEREPHTHALATE ENDCAPPED WITH ALKLARYL HYDROCARBON OSAKA SODA CO. LTD. (JP) 1985-05-21 US disclosed
US-4039793-A PRODUCTION OF MONOCHLORO- AND ARYL SUBSTITUTED SATURATED COMPOUNDS UOP INC. (US) 1977-08-02 US disclosed