SCHEMBL4928668

SCHEMBL4928668

Cc1cc2cc3ccccc3cc2c(N)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.39
HSD17B10 Q99714 4/20 0.39
TDP1 Q9NUW8 3/20 0.39
CYP3A4 P08684 2/20 0.39
ALOX15 P16050 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HBB P68871 1/20 0.39
HIF1A Q16665 1/20 0.39
CYP2A6 P11509 4/20 0.38
CYP1A2 P05177 4/20 0.38
TSHR P16473 1/20 0.38
NQO1 P15559 1/20 0.36
HPGD P15428 4/20 0.36
BACE1 P56817 1/20 0.36
KDM4E B2RXH2 4/20 0.35
GAA P10253 4/20 0.35
PI4KA P42356 1/20 0.35
PI4K2B Q8TCG2 1/20 0.35
PI4K2A Q9BTU6 1/20 0.35

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
SCHEMBL7692618 0.84 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1CYP3A4ALOX15
SCHEMBL1840635 0.83 CYP1A2 (0.48) ALDH1A1HSD17B10TDP1CYP3A4CASP1
SCHEMBL1538428 0.81 CYP1A2 (0.41) ALDH1A1HSD17B10TDP1HIF1ACYP2A6
SCHEMBL29512148 0.81 CYP1A2 (0.41) ALDH1A1HSD17B10TDP1HIF1ACYP2A6
SCHEMBL22776396 0.80 ALDH1A1 (0.50) ALDH1A1HSD17B10TDP1CYP3A4ALOX15
SCHEMBL5750258 0.78 ALDH1A1 (0.57) ALDH1A1HSD17B10TDP1CYP3A4ALOX15
SCHEMBL11674694 0.76 CYP2A6 (0.38) ALDH1A1HSD17B10TDP1HIF1ACYP2A6
SCHEMBL11512759 0.76 CYP2A6 (0.38) ALDH1A1HSD17B10TDP1HIF1ACYP2A6
SCHEMBL20735452 0.76 ALDH1A1 (0.55) ALDH1A1HSD17B10TDP1CYP3A4ALOX15
SCHEMBL8376482 0.76 BRD4 (0.40) ALDH1A1HSD17B10TDP1HIF1ACYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020131440-A1 GREASE COMPOSITIONS HAVING CALCIUM SULFONATE AND POLYUREA THICKENERS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2020-06-25 WO disclosed
US-20200199481-A1 GREASE COMPOSITIONS HAVING CALCIUM SULFONATE AND POLYUREA THICKENERS EXXONMOBIL RES & ENG CO (US) 2020-06-25 US disclosed
EP-3113857-A1 CHROMATOGRAPHIC MATERIALS FOR THE SEPARATION OF UNSATURATED MOLECULES Waters Technologies Corporation (US) 2017-01-11 EP disclosed
WO-2015134317-A9 CHROMATOGRAPHIC MATERIALS FOR THE SEPARATION OF UNSATURATED MOLECULES WATERS TECHNOLOGIES CORPORATION (US) 2016-08-04 WO disclosed
WO-2015134317-A1 CHROMOTOGRAPHIC MATERIALS FOR THE SEPARATION OF UNSATURATED MOLECULES WATERS TECHNOLOGIES CORPORATION (US) 2015-09-11 WO disclosed
EP-1840399-B1 COLLAPSIBLE COLUMN NSK LTD (JP) 2014-06-18 EP disclosed
US-20080125231-A1 Telescopic Shaft NSK LTD. (JP) 2008-05-29 US disclosed
EP-1840399-A1 COLLAPSIBLE COLUMN NSK Ltd., (JP) 2007-10-03 EP disclosed
US-20060073989-A1 Grease compostion for automobile electrical equipment auxiliary device and prelubricated rolling using the grease composition NSK LTD. (JP) 2006-04-06 US disclosed
US-6919301-B2 Grease composition and rolling apparatus NSK LTD. (JP) 2005-07-19 US disclosed
EP-1339800-B1 SQUARAINE BASED DYES AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2004-11-24 EP disclosed
US-20030176298-A1 Grease composition and rolling apparatus NSK LTD. (JP) 2003-09-18 US disclosed
EP-1339800-A1 SQUARAINE BASED DYES AND PROCESS FOR PREPARATION THEREOF Council of Scientific and Industrial Research (IN) 2003-09-03 EP disclosed
WO-2003035768-A1 SQUARAINE BASED DYES AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2003-05-01 WO disclosed
US-6417402-B1 WITH TERMINAL AMINOANTHRACENE OR ACRIDINE GROUPS; IMMUNOASSAY, FLUORESCENT DYES; IMAGING, ELECTROGRAPHY, XEROGRAPHY COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2002-07-09 US disclosed