SCHEMBL337159

SCHEMBL337159

CCc1cc(Cc2cc(CC)c(N)cc2Cl)c(Cl)cc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
GAA P10253 2/20 0.40
CYP1A2 P05177 1/20 0.40
ALOX15 P16050 1/20 0.40
CASP7 P55210 1/20 0.40
HIF1A Q16665 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
CD44 P16070 1/20 0.38
CYP3A4 P08684 1/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 1/20 0.34
AR P10275 1/20 0.33
CA12 O43570 1/20 0.32

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
SCHEMBL12963082 0.84 GAA (0.46) ALDH1A1GAACYP1A2ALOX15CASP7
SCHEMBL7470752 0.79 CD44 (0.48) ALDH1A1GAAALOX15GRIN2DGRIN3B
SCHEMBL8729779 0.79 ALDH1A1 (0.44) ALDH1A1GAACYP1A2ALOX15CASP7
SCHEMBL29225682 0.79 GAA (0.50) ALDH1A1GAACYP1A2ALOX15CASP7
SCHEMBL118865 0.78 ALDH1A1 (0.46) ALDH1A1CYP1A2ALOX15CASP7HIF1A
SCHEMBL10948580 0.77 GAA (0.57) ALDH1A1GAAALOX15HSD17B10GRIN2D
SCHEMBL1807453 0.77 GAA (0.63) ALDH1A1GAACYP1A2ALOX15CASP7
SCHEMBL11468902 0.76 AR (0.42) ALDH1A1CYP1A2ALOX15CASP7HIF1A
SCHEMBL10341258 0.76 ALDH1A1 (0.64) ALDH1A1GAACYP1A2ALOX15CASP7
SCHEMBL832574 0.75 ALDH1A1 (0.43) ALDH1A1CYP1A2ALOX15CASP7HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012001527-A3 METHOD FOR IMPROVING CLEAVAGE OF DNA BY ENDONUCLEASE SENSITIVE TO METHYLATION CELLECTIS S.A. (FR) 2012-05-10 WO claimed
EP-2155797-B1 NCO PREPOLYMERS WITH A LOW FREE MONOMERIC DIISOCYANATE CONTENT AND PRODUCTION THEREOF BAYER MATERIALSCIENCE AG (DE) 2011-11-30 EP claimed
US-20100273908-A1 NCO PREPOLYMERS HAVING A LOW CONTENT OF FREE MONOMERIC DIISOCYANATE, AND THE PRODUCTION THEREOF BAYER MATERIALSCIENCE AG (DE) 2010-10-28 US claimed
EP-2155797-A1 NCO PREPOLYMERS WITH A LOW FREE MONOMERIC DIISOCYANATE CONTENT AND PRODUCTION THEREOF Bayer MaterialScience AG (DE) 2010-02-24 EP claimed
US-20080306176-A1 NCO Prepolymers Having A Low Content Of Free Monomeric Diisocyanate, And The Production Thereof BAYER MATERIALSCIENCE AG (DE) 2008-12-11 US claimed
WO-2008145280-A1 NCO PREPOLYMERS WITH A LOW FREE MONOMERIC DIISOCYANATE CONTENT AND PRODUCTION THEREOF BAYER MATERIALSCIENCE AG (DE) 2008-12-04 WO claimed
EP-1981923-A1 POLYURETHANE CAST ELASTOMERS FORMED FROM NCO PREPOLYMERS BASED ON 2,4'-MDI, A PROCESS FOR THEIR PREPARATION AND THEIR USE Bayer MaterialScience AG (DE) 2008-10-22 EP claimed
WO-2007087987-A1 POLYURETHANE CAST ELASTOMERS FORMED FROM NCO PREPOLYMERS BASED ON 2,4'-MDI, A PROCESS FOR THEIR PREPARATION AND THEIR USE BAYER MATERIALSCIENCE AG (DE) 2007-08-09 WO claimed
US-20070155941-A1 Polyurethane cast elastomers made of NCO prepolymers based on 2,4'-MDI and a process for their preparation BAYER MATERIALSCIENCE AG (DE) 2007-07-05 US claimed
CN-107921709-B Improved manufacturability of amorphous polymers in powder bed melting processes 沙特基础工业全球技术有限公司 2020-08-07 CN disclosed
CN-107250215-B Poly (amic acid) synthesis and conversion to high molecular weight polyimides 沙特基础工业全球技术有限公司 2020-02-28 CN disclosed
CN-107406672-B Tracking resistant compositions, articles formed therefrom, and methods of making the same 沙特基础工业全球技术有限公司 2020-01-10 CN disclosed
CN-107250268-B Tracking resistant compositions, articles formed therefrom, and methods of making the same 沙特基础工业全球技术有限公司 2019-12-27 CN disclosed
EP-2262842-B1 2,2'-MDI-BASED ISOCYANATE MIXTURES AND THE PRODUCTION AND USE THEREOF POLYTEX SPORTBELÄGE PRODUKTIONS-GMBH (DE) 2018-01-24 EP disclosed
WO-2009118112-A2 2,2'-MDI-BASED ISOCYANATE MIXTURES AND THE PRODUCTION AND USE THEREOF BAYER MATERIALSCIENCE AG (DE) 2009-10-01 WO disclosed
US-20080306176-A1 NCO Prepolymers Having A Low Content Of Free Monomeric Diisocyanate, And The Production Thereof BAYER MATERIALSCIENCE AG (DE) 2008-12-11 US disclosed
WO-2008145280-A1 NCO PREPOLYMERS WITH A LOW FREE MONOMERIC DIISOCYANATE CONTENT AND PRODUCTION THEREOF BAYER MATERIALSCIENCE AG (DE) 2008-12-04 WO disclosed
EP-1981923-A1 POLYURETHANE CAST ELASTOMERS FORMED FROM NCO PREPOLYMERS BASED ON 2,4'-MDI, A PROCESS FOR THEIR PREPARATION AND THEIR USE Bayer MaterialScience AG (DE) 2008-10-22 EP disclosed
WO-2007087987-A1 POLYURETHANE CAST ELASTOMERS FORMED FROM NCO PREPOLYMERS BASED ON 2,4'-MDI, A PROCESS FOR THEIR PREPARATION AND THEIR USE BAYER MATERIALSCIENCE AG (DE) 2007-08-09 WO disclosed
US-20070155941-A1 Polyurethane cast elastomers made of NCO prepolymers based on 2,4'-MDI and a process for their preparation BAYER MATERIALSCIENCE AG (DE) 2007-07-05 US disclosed