SCHEMBL7861345

SCHEMBL7861345

Clc1cccc2[nH]c(Br)[c]c12

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 5/20 0.37
NOS1 P29475 1/20 0.33
GRIA1 P42261 1/20 0.33
CACNG8 Q8WXS5 1/20 0.33
DAO P14920 1/20 0.33
DYRK1A Q13627 1/20 0.32
RHEB Q15382 1/20 0.32
ERCC5 P28715 1/20 0.32
FEN1 P39748 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
PNMT P11086 1/20 0.32
GAA P10253 1/20 0.32
HTR2C P28335 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
ADORA3 P0DMS8 1/20 0.30
ADORA1 P30542 1/20 0.30
NUDT1 P36639 1/20 0.30

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
SCHEMBL7289576 0.79 PSMB8 (0.41) PSMB8NOS1DAODYRK1ARHEB
SCHEMBL7800470 0.68 PSMB8 (0.39) PSMB8NOS1FEN1CYP2A6
SCHEMBL20276479 0.64 ERCC5 (0.50) PSMB8NOS1DYRK1AERCC5FEN1
SCHEMBL21145351 0.63 GABRP (0.48) DAODYRK1AERCC5FEN1
SCHEMBL6009055 0.63 ERCC5 (0.53) PSMB8NOS1DYRK1AERCC5FEN1
SCHEMBL31619545 0.63 ERCC5 (0.53) PSMB8NOS1DYRK1AERCC5FEN1
SCHEMBL321694 0.63 GPR84 (0.41) PSMB8NOS1DAODYRK1ARHEB
SCHEMBL558395 0.61 NOS1 (0.42) PSMB8NOS1GPR84GAACYP1A2
SCHEMBL7459887 0.60 GPR84 (0.39) PSMB8NOS1DYRK1AERCC5FEN1
SCHEMBL31534795 0.60 PSMB8 (0.56) PSMB8NOS1GAAADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2773765-A1 METHODS USING ACYL-COENZYME A-BINDING PROTEINS TO ENHANCE DROUGHT TOLERANCE IN GENETICALLY MODIFIED PLANTS The University of Hong Kong (CN) 2014-09-10 EP disclosed
WO-2013064119-A1 METHODS USING ACYL-COENZYME A-BINDING PROTEINS TO ENHANCE DROUGHT TOLERANCE IN GENETICALLY MODIFIED PLANTS THE UNIVERSITY OF HONG KONG (CN) 2013-05-10 WO disclosed
US-20010055590-A1 Method for enhancing myoblast migration and invasion in the context of gene therapy NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2001-12-27 US disclosed