SCHEMBL3672929

SCHEMBL3672929

CC(CC(C)c1ccccc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 4/20 0.67
TAAR1 Q96RJ0 5/20 0.64
AOC3 Q16853 2/20 0.56
RIPK1 Q13546 1/20 0.54
HRH1 P35367 2/20 0.45
CACNA1F O60840 1/20 0.45
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
ADRA2B P18089 1/20 0.45
CHRM3 P20309 1/20 0.45
ADRA1A P35348 1/20 0.45
OPRK1 P41145 1/20 0.45
CACNA1D Q01668 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KCNH2 Q12809 1/20 0.45
CACNA1S Q13698 1/20 0.45
CACNA1C Q13936 1/20 0.45
SCN5A Q14524 1/20 0.45
HTR2A P28223 2/20 0.44
LMNA P02545 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
SCHEMBL508412 0.89 TRPA1 (0.61) TRPA1TAAR1AOC3RIPK1HRH1
SCHEMBL9579271 0.89 TRPA1 (0.61) TRPA1TAAR1AOC3RIPK1HRH1
SCHEMBL3864354 0.89 TRPA1 (0.61) TRPA1TAAR1AOC3RIPK1HRH1
SCHEMBL6546413 0.88 TRPA1 (0.55) TRPA1TAAR1AOC3RIPK1LMNA
Hydrogen Peroxide SCHEMBL11213135 0.87 TRPA1 (0.65) TRPA1TAAR1AOC3RIPK1LMNA
SCHEMBL3674520 0.87 TRPA1 (0.59) TRPA1TAAR1AOC3RIPK1HRH1
SCHEMBL17038679 0.87 TRPA1 (0.59) TRPA1TAAR1AOC3RIPK1HRH1
SCHEMBL19420426 0.86 TRPA1 (0.60) TRPA1TAAR1AOC3CHRM2CHRM1
SCHEMBL19317395 0.86 TRPA1 (0.53) TRPA1TAAR1AOC3RIPK1KDM4E
SCHEMBL9587274 0.86 SLC6A2 (0.58) TRPA1TAAR1AOC3RIPK1SLC6A3

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2947112-B1 METHOD FOR PRODUCING POLYBENZOXAZOLE RESIN TOKYO OHKA KOGYO CO LTD (JP) 2017-09-13 EP disclosed
US-20170115563-A1 ENERGY-SENSITIVE RESIN COMPOSITION TOKYO OHKA KOGYO CO., LTD. (JP) 2017-04-27 US disclosed
WO-2016158679-A1 ENERGY-SENSITIVE RESIN COMPOSITION 東京応化工業株式会社 2016-10-06 WO disclosed
WO-2015198887-A1 ENERGY-SENSITIVE RESIN COMPOSITION 東京応化工業株式会社 2015-12-30 WO disclosed
US-20150337084-A1 METHOD FOR PRODUCING POLYBENZOXAZOLE RESIN TOKYO OHKA KOGYO CO., LTD. (JP) 2015-11-26 US disclosed
EP-2947112-A1 METHOD FOR PRODUCING POLYBENZOXAZOLE RESIN TOKYO OHKA KOGYO CO., LTD. (JP) 2015-11-25 EP disclosed
CN-103459360-B Method for producing 4,4'-diformyldiphenylalkane MITSUBISHI GAS CHEMICAL CO 2015-06-10 CN disclosed
EP-2692717-B1 METHOD FOR PRODUCING 4,4'-DIFORMYLDIPHENYLALKANE MITSUBISHI GAS CHEMICAL CO (JP) 2015-05-13 EP disclosed
US-8969627-B2 Method for producing 4,4'-diformyldiphenylalkane MITSUBISHI GAS CHEMICAL COMPANY, INC (JP) 2015-03-03 US disclosed
EP-2692717-A1 METHOD FOR PRODUCING 4,4'-DIFORMYLDIPHENYLALKANE Mitsubishi Gas Chemical Company, Inc. (JP) 2014-02-05 EP disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed
EP-0224259-B1 A WORKING FLUID FOR TRACTION DRIVE IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-02-10 EP disclosed
EP-0230920-B1 FLUID FOR TRACTION DRIVE IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-01-08 EP disclosed
EP-0135871-B1 TRACTION DRIVE FLUIDS IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-12-27 EP disclosed
US-4704490-A SYNERGISTIC MIXTURE OF ALICYCLIC HYDROCARBONS IDEMITSU KOSAN COMPANY, LIMITED (JP) 1987-11-03 US disclosed
EP-0230920-A2 Fluid for traction drive IDEMITSU KOSAN COMPANY LIMITED (JP) 1987-08-05 EP disclosed
US-4684754-A DECAHYDRONAPHTHALENE DERIVATIVES IDEMITSU KOSAN COMPANY LIMITED (JP) 1987-08-04 US disclosed
EP-0224259-A2 A working fluid for traction drive IDEMITSU KOSAN COMPANY LIMITED (JP) 1987-06-03 EP disclosed
US-4556503-A Traction drive fluids IDEMITSU KOSAN COMPANY LIMITED (JP) 1985-12-03 US disclosed
EP-0135871-A2 Traction drive fluids IDEMITSU KOSAN COMPANY LIMITED (JP) 1985-04-03 EP disclosed