SCHEMBL258675

SCHEMBL258675

Cc1c(O)cccc1CC(C)C

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.63
GABRB2 P47870 3/20 0.63
TRPA1 O75762 2/20 0.46
ATM Q13315 1/20 0.46
ELANE P08246 1/20 0.44
CTSG P08311 1/20 0.44
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 2/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HSPA5 P11021 1/20 0.38
POLB P06746 1/20 0.38
HTR2A P28223 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL22781148 0.84 GABRA1 (0.62) GABRA1GABRB2ELANECTSGHSD17B10
SCHEMBL1053654 0.81 GABRA1 (0.79) GABRA1GABRB2TRPA1ELANECTSG
SCHEMBL18330585 0.81 MAPK1 (0.44) GABRA1GABRB2TRPA1ATMHSD17B10
SCHEMBL108067 0.80 GABRA1 (0.64) GABRA1GABRB2ELANECTSGMAPK1
SCHEMBL28789602 0.80 GABRA1 (0.44) GABRA1GABRB2TRPA1ATMHSD17B10
SCHEMBL258656 0.79 GABRA1 (0.63) GABRA1GABRB2ELANECTSGHSD17B10
SCHEMBL24581179 0.79 GABRA1 (0.57) GABRA1GABRB2TRPA1ATMELANE
SCHEMBL1548303 0.79 TRPA1 (0.42) GABRA1GABRB2TRPA1ATMHSD17B10
SCHEMBL11677650 0.78 GABRA1 (0.56) GABRA1GABRB2TRPA1ATMHSD17B10
SCHEMBL8900885 0.78 TRPA1 (0.50) GABRA1GABRB2TRPA1ATMHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7384434-B2 Reaction of phenols with intermediate triazines AFTON CHEMICAL CORPORATION (US) 2008-06-10 US claimed
US-20060196111-A1 Fuel additive composition AFTON CHEMICAL CORPORATION 2006-09-07 US claimed
US-20060196107-A1 Cyclic mannich products AFTON CHEMICAL CORPORATION 2006-09-07 US claimed
EP-1645614-A1 Preparation of amine derivates from nitriles and phenols Afton Chemical Corporation (US) 2006-04-12 EP claimed
US-20060059771-A1 Preparation of amine derivates from nitriles and phenols AFTON CHEMICAL CORPORATION 2006-03-23 US claimed
US-20050268538-A1 Reaction of phenols with intermediate triazines AFTON CHEMICAL CORPORATION 2005-12-08 US claimed
US-20240132791-A1 FUEL COMPOSITION AFTON CHEMICAL CORPORATION 2024-04-25 US disclosed
WO-2024068384-A1 FUEL COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2024-04-04 WO disclosed
EP-4345152-A1 FUEL COMPOSITION Afton Chemical Corporation (US) 2024-04-03 EP disclosed
CN-117801850-A Fuel composition 雅富顿化学公司 2024-04-02 CN disclosed
EP-3375848-B1 POLYOL CARRIER FLUIDS AND FUEL COMPOSITIONS INCLUDING POLYOL CARRIER FLUIDS AFTON CHEMICAL CORP (US) 2022-01-12 EP disclosed
EP-3697873-B1 METHOD FOR REDUCING LOW SPEED PRE-IGNITION SHELL INT RESEARCH (NL) 2021-05-26 EP disclosed
CN-110546242-B Polyol carrier fluid and fuel composition comprising a polyol carrier fluid 雅富顿化学公司 2021-02-26 CN disclosed
CN-1749370-A Preparation of amine derivates from nitriles and phenols AFTON CHEMICAL CORP (US) 2006-03-22 CN disclosed
US-20050268538-A1 Reaction of phenols with intermediate triazines AFTON CHEMICAL CORPORATION 2005-12-08 US disclosed
EP-1602707-A1 Process for preparing mannich products for uses as fuel additives by reaction of phenols with hexahydro-1,3,5-Triazines Afton Chemical Corporation (US) 2005-12-07 EP disclosed
EP-1285579-B1 Bactericidal guanidine derivatives, dermally applicable composition, washing composition, and antibacterial fibre aggregate AJINOMOTO KK (JP) 2005-11-02 EP disclosed
EP-1285579-A1 Bactericidal guanidine derivatives, dermally applicable composition, washing composition, and antibacterial fibre aggregate Ajinomoto Co., Inc. (JP) 2003-02-26 EP disclosed
WO-1997030103-A2 PREPARATION OF POLYETHERAMINES AND POLYETHERAMINE DERIVATIVES THE DOW CHEMICAL COMPANY (US) 1997-08-21 WO disclosed
US-5112364-A Improved valve cleaning BASF AKTIENGESELLSCHAFT (DE) 1992-05-12 US disclosed