SCHEMBL800835

SCHEMBL800835

Cc1ccc(N=C=Nc2ccc(C)c(NC(=O)N3CCCCCC3=O)c2)cc1NC(=O)N1CCCCCC1=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 1/20 0.49
ITGA4 P13612 1/20 0.49
TP53 P04637 3/20 0.41
RAB9A P51151 3/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 2/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
MITF O75030 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL18560700 0.96 ITGB1 (0.46) ITGB1ITGA4TP53RAB9AKMT2A
SCHEMBL18561735 0.94 ITGB1 (0.44) ITGB1ITGA4TP53RAB9AKMT2A
SCHEMBL15386823 0.82 ITGB1 (0.54) ITGB1ITGA4TP53RAB9AKMT2A
SCHEMBL24200395 0.75 RAB9A (0.50) ITGB1ITGA4TP53RAB9AKMT2A
SCHEMBL12167106 0.74 RAB9A (0.46) ITGB1ITGA4TP53RAB9AKMT2A
SCHEMBL27657647 0.70 NPC1 (0.63) ITGB1ITGA4TP53RAB9AKMT2A
SCHEMBL13040541 0.68 KMT2A (0.50) ITGB1ITGA4TP53RAB9AKMT2A
SCHEMBL20476406 0.68 CYP3A4 (0.46) TP53RAB9AKMT2ANPC1MAPT
SCHEMBL15386127 0.67 ITGB1 (0.53) ITGB1ITGA4KMT2AMEN1MAPT
SCHEMBL9155742 0.67 SMN1; SMN2 (0.54) ITGB1ITGA4TP53RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423185-B1 NEW AQUEOUS RESORCINOL-FORMALDEHYDE-LATEX DISPERSIONS, FIBERS WITH IMPROVED ADHESION, PROCESS FOR THEIR PREPARATION AND USE THEREOF. RHEIN CHEMIE RHEINAU GMBH (DE) 2017-03-01 EP disclosed
US-9181394-B2 Composition for producing cast polyamides RHEIN CHEMIE RHEINAU GMBH (DE) 2015-11-10 US disclosed
US-9181394-B2 Composition for producing cast polyamides RHEIN CHEMIE RHEINAU GMBH (DE) 2015-11-10 US disclosed
US-8481619-B2 Aqueous resorcinol-formaldehyde-latex dispersions, adhesion-improved fibres, processes for production thereof and use thereof RHEIN CHEMIE RHEINAU GMBH (US) 2013-07-09 US disclosed
US-8481619-B2 Aqueous resorcinol-formaldehyde-latex dispersions, adhesion-improved fibres, processes for production thereof and use thereof RHEIN CHEMIE RHEINAU GMBH (US) 2013-07-09 US disclosed
US-20120071595-A1 Novel aqueous resorcinol-formaldehyde-latex dispersions, adhesion-improved fibres, processes for production thereof and use thereof RHEIN CHEMIE RHEINAU GMBH (DE) 2012-03-22 US disclosed
US-20120071595-A1 Novel aqueous resorcinol-formaldehyde-latex dispersions, adhesion-improved fibres, processes for production thereof and use thereof RHEIN CHEMIE RHEINAU GMBH (DE) 2012-03-22 US disclosed
EP-2423185-A1 New aqueous resorcinol-formaldehyde-latex dispersions, fibers with improved adhesion, process for their preparation and use thereof Rhein Chemie Rheinau GmbH (DE) 2012-02-29 EP disclosed