SCHEMBL6675604

SCHEMBL6675604

CC(C)Cc1cccc(O)c1N

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.61
GABRB2 P47870 2/20 0.61
ELANE P08246 1/20 0.43
CTSG P08311 1/20 0.43
KDM4E B2RXH2 2/20 0.39
USP2 O75604 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
G6PD P11413 1/20 0.38
CASP7 P55210 1/20 0.38
CASP6 P55212 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA2 P47869 1/20 0.38
HSPA5 P11021 1/20 0.37
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37
HIF1A Q16665 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TAAR1 Q96RJ0 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
SCHEMBL3960659 0.85 GABRA1 (0.60) GABRA1GABRB2ELANECTSGGABRG2
SCHEMBL1053654 0.79 GABRA1 (0.79) GABRA1GABRB2ELANECTSGHPGD
SCHEMBL16101465 0.79 GABRA1 (0.54) GABRA1GABRB2HPGDHSD17B10GABRG2
SCHEMBL108067 0.79 GABRA1 (0.64) GABRA1GABRB2ELANECTSGHSPA5
SCHEMBL29875751 0.78 TAAR1 (0.50) GABRA1GABRB2KDM4EHPGDHSD17B10
SCHEMBL11096139 0.78 GABRA1 (0.52) GABRA1GABRB2GABRG2GABRB3GABRA2
SCHEMBL258656 0.78 GABRA1 (0.63) GABRA1GABRB2ELANECTSGKDM4E
Hydrochloric Acid SCHEMBL28797189 0.78 GABRA1 (0.52) GABRA1GABRB2GABRG2GABRB3GABRA2
SCHEMBL258675 0.78 GABRA1 (0.63) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL1660862 0.77 GABRA1 (0.56) GABRA1GABRB2G6PDCASP7CASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1442009-A1 PRODUCTION OF KETO ACIDS Ciba SC Holding AG (CH) 2004-08-04 EP disclosed
EP-0628622-B1 The use of a lubricant for direct-fuel injected two-stroke engine LUBRIZOL CORP (US) 2004-07-28 EP disclosed
EP-0769546-B1 Antiwear enhancing composition for lubricants and functional fluids LUBRIZOL CORP (US) 2003-07-30 EP disclosed
WO-2003037846-A1 PRODUCTION OF KETO ACIDS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-05-08 WO disclosed
EP-0787791-B1 Functional fluid compositions having improved frictional and anti-oxidation properties LUBRIZOL CORP (US) 2002-12-18 EP disclosed
EP-1115579-A1 MONOPHASE SOLID SOLUTIONS COMPRISING A PLURALITY OF COLOUR FORMER COMPOUNDS AND PROCESS FOR THEIR PREPARATION Ciba SC Holding AG (CH) 2001-07-18 EP disclosed
EP-1107972-A1 PREPARATION PROCESS FOR MANUFACTURE AND PURIFICATION OF MIXTURES OF FLUORAN COMPOUNDS AND RECORDING MATERIAL COMPRISING SAID MIXTURES OF FLUORAN Ciba SC Holding AG (CH) 2001-06-20 EP disclosed
US-6242394-B1 LUBRICANT WITH ANTIWEAR ADDITIVE, PHENOL, MANNICH DISPERSANT AND OXIDATION RESISTANT ADDITIVES THE LUBRIZOL CORPORATION 2001-06-05 US disclosed
WO-2000026037-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-05-11 WO disclosed
WO-2000012513-A1 NOVEL PREPARATION PROCESS FOR MANUFACTURE AND PURIFICATION OF MIXTURES OF FLUORAN COMPOUNDS AND RECORDING MATERIAL COMPRISING SAID MIXTURES OF FLUORAN COMPOUNDS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-03-09 WO disclosed
WO-2000012318-A1 MONOPHASE SOLID SOLUTIONS COMPRISING A PLURALITY OF COLOUR FORMER COMPOUNDS AND PROCESS FOR THEIR PREPARATION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-03-09 WO disclosed
US-5759965-A OVERBASED COMPOUND; AUTOMATIC TRANSMISSION FLUID THE LUBRIZOL CORPORATION (US) 1998-06-02 US disclosed
EP-0787791-A2 Functional fluid compositions having improved frictional and anti-oxidation properties The Lubrizol Corporation (US) 1997-08-06 EP disclosed
EP-0769546-A2 Antiwear enhancing composition for lubricants and functional fluids The Lubrizol Corporation (US) 1997-04-23 EP disclosed
US-5561103-A CONTAINING SELF CONDENSATION PRODUCTS OF ALKYLTHIO ALKANOLS AND DISPERSANTS; LUBRICANTS THE LUBRIZOL CORPORATION (US) 1996-10-01 US disclosed
EP-0628622-A1 Two-stroke cycle lubricant and method of using same THE LUBRIZOL CORPORATION (US) 1994-12-14 EP disclosed
US-4613879-A 3-N-ISOBUTYLETHYLAMINO-6-METHYL-7-PHENYLAMINOFLUORAN SHIN NISSO KAKO CO., LTD. (JP) 1986-09-23 US disclosed