SCHEMBL6832941

SCHEMBL6832941

COc1cnc(NC(=O)NS(=O)(=O)c2c(Cl)nc3ccccn23)nc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPK1 P28482 2/20 0.41
MAPT P10636 4/20 0.40
ALDH1A1 P00352 4/20 0.40
GAA P10253 2/20 0.37
DAPK3 O43293 1/20 0.36
JAK2 O60674 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36
ABL1 P00519 1/20 0.36
CSF1R P07333 1/20 0.36
RET P07949 1/20 0.36
MET P08581 1/20 0.36
PDGFRA P16234 1/20 0.36
PRKACA P17612 1/20 0.36
LTK P29376 1/20 0.36
GRK5 P34947 1/20 0.36
KDR P35968 1/20 0.36
MAPK8 P45983 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
SCHEMBL4473565 0.86 MAPT (0.35) RAB9AMAPTALDH1A1GAADAPK3
SCHEMBL8535700 0.82 GAA (0.52) RAB9ASMN1; SMN2MAPK1MAPTALDH1A1
SCHEMBL55236 0.82 GAA (0.52) RAB9ASMN1; SMN2MAPK1MAPTALDH1A1
SCHEMBL9362781 0.79 GAA (0.46) RAB9ASMN1; SMN2MAPK1MAPTALDH1A1
SCHEMBL12633039 0.78 GAA (0.46) RAB9ASMN1; SMN2MAPK1MAPTALDH1A1
SCHEMBL20548294 0.77 NPC1 (0.32) RAB9AALDH1A1GAAKDM4EMEN1
SCHEMBL9518738 0.76 SMN1; SMN2 (0.47) RAB9ASMN1; SMN2MAPK1MAPTALDH1A1
SCHEMBL10968069 0.75 CA2 (0.43) MAPTALDH1A1GAAKDM4EKMT2A
SCHEMBL5904842 0.75 RAB9A (0.46) RAB9ASMN1; SMN2MAPK1MAPTALDH1A1
SCHEMBL8480505 0.75 GAA (0.53) MAPTALDH1A1GAADAPK3JAK2

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
US-6746684-B2 CORE COATED WITH A RESIN WALL MATERIAL FORMED BY WATER-SOLUBLE MELAMINE-FORMALDEHYDE RESIN TO POLYCONDENSATION IN A DISPERSANT OF CONDENSATION PRODUCT OF (ALKYL)NAPHTHALENE-SULFONIC ACID AND FORMALDEHYDE SYNGENTA CROP PROTECTION, INC. 2004-06-08 US disclosed
EP-1170997-B1 MICROENCAPSULATED SOLID PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2003-03-26 EP disclosed
US-20020081337-A1 Microencapsulated solid pesticides MERRILL LYNCH CAPITAL, A DIVISION OF MERRILL LYNCH 2002-06-27 US disclosed