SCHEMBL195800

SCHEMBL195800

O=C(O)c1ccc(C(=O)O)c2c1CCCCCC2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
GFER P55789 1/20 0.44
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 3/20 0.42
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALOX15 P16050 1/20 0.42
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
FABP4 P15090 5/20 0.41
XDH P47989 1/20 0.40
TSHR P16473 2/20 0.39
SELL P14151 1/20 0.39
SELP P16109 1/20 0.39
RXRA P19793 3/20 0.39
RXRB P28702 2/20 0.39
RXRG P48443 2/20 0.39
HPGD P15428 2/20 0.38
HSD17B10 Q99714 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
SCHEMBL3107923 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL3091854 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL2034342 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL250454 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
Cyclohexane SCHEMBL1538047 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL87519 0.97 CYP1A2 (0.57) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL982478 0.95 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
Cyclohexane SCHEMBL483378 0.92 CYP1A2 (0.57) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL251512 0.92 CYP1A2 (0.57) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL973641 0.90 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2650413-B1 HYDROGELLING FIBRES AND FIBRE STRUCTURES FREUDENBERG CARL KG (DE) 2019-05-01 EP claimed
US-9760032-B1 Toner composition and process XEROX CORPORATION (US) 2017-09-12 US claimed
US-20170248859-A1 TONER COMPOSITION AND PROCESS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL AGENT 2017-08-31 US claimed
EP-2627813-B1 HYDROGEL FIBRES AND FIBROUS STRUCTURES FREUDENBERG CARL KG (DE) 2015-11-11 EP claimed
US-9128396-B2 Chemical binding of renewable oils to polyester emulsion XEROX CORPORATION (US) 2015-09-08 US claimed
US-20140178811-A1 CHEMICAL BINDING OF RENEWABLE OILS TO POLYESTER EMULSION XEROX CORPORATION (US) 2014-06-26 US claimed
US-20140030646-A1 CHEMICAL BINDING OF RENEWABLE OILS TO POLYESTER EMULSION XEROX CORPORATION (US) 2014-01-30 US claimed
JP-4851059-B2 2012-01-11 JP claimed
EP-1373391-B1 POLYESTER BOTTLE HAVING A REDUCED COEFFICIENT OF FRICTION AND IMPROVED CLARITY GRUPO PETROTEMEX SA DE CV (MX) 2012-01-04 EP claimed
US-7785763-B2 Emulsion aggregation processes XEROX CORPORATION (US) 2010-08-31 US claimed
US-20010023020-A1 Implantable fibers and medical articles SOLUTIA INC. (US) 2001-09-20 US claimed
US-6162537-A Implantable fibers and medical articles SOLUTIA INC. (US) 2000-12-19 US claimed
US-6096818-A COMPOSITION COMPRISING THERMOPLASTIC POLYESTER, BROMINE-CONTAINING FLAME RETARDANT, ANTIMONY COMPOUND, CONDUCTIVE CARBON BLACK PARTICLES KANEKA CORPORATION (JP) 2000-08-01 US claimed
EP-0935682-A1 IMPLANTABLE FIBERS AND MEDICAL ARTICLES Monsanto Company (US) 1999-08-18 EP claimed
WO-1998020190-A1 IMPLANTABLE FIBERS AND MEDICAL ARTICLES MONSANTO COMPANY (US) 1998-05-14 WO claimed
EP-0579545-B1 Liquid crystal display device MINNESOTA MINING & MFG (US) 1997-03-12 EP claimed
US-5591559-A Supercritical toner processes XEROX CORPORATION (US) 1997-01-07 US claimed
EP-0386256-B1 AROMATIC POLYESTER RESIN COMPOSITION AND FIBERS THEREOF TEIJIN LTD (JP) 1996-05-01 EP claimed
EP-0437942-B1 Polymeric film ICI PLC (GB) 1994-11-23 EP claimed
EP-0015145-B1 POLYESTER COMPOSITIONS AND PROCESSES FOR MOULDING THEM ROHM AND HAAS COMPANY (US) 1984-01-25 EP claimed