SCHEMBL2299274

SCHEMBL2299274

Cc1ccc(C(C)(C)c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.62
ESR2 Q92731 4/20 0.62
CYP3A4 P08684 2/20 0.62
ALDH1A1 P00352 1/20 0.62
TSHR P16473 3/20 0.55
LMNA P02545 1/20 0.50
ALOX12 P18054 1/20 0.50
ACHE P22303 1/20 0.50
CNR1 P21554 3/20 0.49
CNR2 P34972 3/20 0.49
NR3C2 P08235 3/20 0.48
KIF11 P52732 3/20 0.48
HPGD P15428 2/20 0.46
AR P10275 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR6 P50406 1/20 0.46
ESRRG P62508 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL12029052 0.93 ESR1 (0.56) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL7535051 0.89 ESR1 (0.75) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL4942966 0.89 TSHR (0.67) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL18901114 0.89 TSHR (0.67) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL14571901 0.87 HPGD (0.65) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL14910456 0.86 ESR1 (0.70) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL35881 0.86 ESR1 (0.70) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL22171819 0.85 ESR1 (0.65) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL10776423 0.84 HPGD (0.68) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL19200980 0.84 ESR1 (0.62) ESR1ESR2CYP3A4ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023185931-A1 P2X3 INHIBITOR COMPOUND, SALT THEREOF, POLYMORPH THEREOF AND USE THEREOF 人福医药集团股份公司 2023-10-05 WO claimed
WO-2023185931-A1 P2X3 INHIBITOR COMPOUND, SALT THEREOF, POLYMORPH THEREOF AND USE THEREOF 人福医药集团股份公司 2023-10-05 WO disclosed
US-20200040117-A1 (METH)ACRYLIC RESIN AND METHOD FOR CONTROLLING STRAIN THEREOF OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) 2020-02-06 US disclosed
US-10358735-B2 Anti-corrosion electrocoat AXALTA COATING SYSTEMS IP CO., LLC (US) 2019-07-23 US disclosed
US-9850351-B2 Polycarbonate-polyorganosiloxane copolymer and method for continuously producing same IDEMITSU KOSAN CO., LTD. (JP) 2017-12-26 US disclosed
US-9567442-B2 Polyorganosiloxane and polycarbonate-polyorganosiloxane copolymer IDEMITSU KOSAN CO., LTD. (JP) 2017-02-14 US disclosed
US-20160257790-A1 POLYCARBONATE-POLYORGANOSILOXANE COPOLYMER AND METHOD FOR CONTINUOUSLY PRODUCING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-09-08 US disclosed
US-20160060399-A1 POLYORGANOSILOXANE AND POLYCARBONATE-POLYORGANOSILOXANE COPOLYMER IDEMITSU KOSAN CO., LTD. (JP) 2016-03-03 US disclosed
US-20150004484-A1 ORGANIC ELECTROLYTE AND ORGANIC ELECTROLYTE STORAGE BATTERY JX NIPPON OIL & ENERGY CORPORATION (JP) 2015-01-01 US disclosed
US-20140370375-A1 ORGANIC ELECTROLYTE AND ORGANIC ELECTROLYTE STORAGE BATTERY JX NIPPON OIL & ENERGY CORPORATION (JP) 2014-12-18 US disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0259798-B1 Electrical insulating oil composition NIPPON PETROCHEMICALS CO LTD (JP) 1997-12-10 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-0399284-B1 Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds BAYER AG (DE) 1995-08-02 EP disclosed
US-5081758-A Impregnation with aromatic hydrocarbon mixture NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-01-21 US disclosed
US-5017733-A Aromatic hydrocarbons NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-05-21 US disclosed
EP-0399284-A2 Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds BAYER AG (DE) 1990-11-28 EP disclosed
EP-0259798-A2 Electrical insulating oil composition NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-03-16 EP disclosed
US-4189391-A MINERAL OIL; A DIARYLALKANE, POLYBUTENE OR HYDROCARBON OIL; POUR POINT DEPRESSANT NIPPON OIL CO., LTD. (JP) 1980-02-19 US disclosed