SCHEMBL6650334

SCHEMBL6650334

Cc1cccc(-c2nccc(C(N)=O)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.49
RAB9A P51151 2/20 0.47
PARP1 P09874 1/20 0.47
TLR8 Q9NR97 2/20 0.47
DHODH Q02127 1/20 0.47
IDE P14735 2/20 0.45
KMT2A Q03164 1/20 0.45
NPC1 O15118 1/20 0.44
CSNK1D P48730 1/20 0.44
CSNK1E P49674 1/20 0.44
MAPK14 Q16539 1/20 0.44
CDC7 O00311 1/20 0.43
KDM5A P29375 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
FGFR3 P22607 1/20 0.41
KDR P35968 1/20 0.41
MAP2K4 P45985 1/20 0.41
GLA P06280 1/20 0.41

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
SCHEMBL6648627 0.83 KMO (0.47) KMORAB9ATLR8IDEKMT2A
SCHEMBL13727965 0.82 CLK4 (0.59) PARP1KMT2A
SCHEMBL13729587 0.81 KMT2A (0.53) PARP1KMT2ANPC1MAP2K4
SCHEMBL29383595 0.81 HDAC6 (0.50) RAB9APARP1KMT2ANPC1
SCHEMBL2543831 0.81 HDAC6 (0.50) RAB9APARP1KMT2ANPC1
SCHEMBL16505375 0.80 SCN9A (0.38) IDEKMT2AKDR
SCHEMBL13728192 0.79 KMO (0.52) KMOPARP1FGFR3KDR
SCHEMBL29960978 0.77 MKNK1 (0.59) CDC7KDM5B
SCHEMBL9081101 0.77 ADORA3 (0.43) PARP1KMT2AKDM5AKDM4CKDM5B
SCHEMBL10594578 0.76 RAB9A (0.50) KMORAB9AIDEKMT2ANPC1

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
WO-2012151567-A1 PYRIMIDINONE COMPOUNDS AND METHODS FOR PREVENTING AND TREATING INFLUENZA ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2012-11-08 WO disclosed
EP-1441734-A1 DIHYDROXYPYRIMIDINE CARBOXAMIDE INHIBITORS OF HIV INTEGRASE Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2004-08-04 EP disclosed
WO-2003035076-A1 DIHYDROXYPYRIMIDINE CARBOXAMIDE INHIBITORS OF HIV INTEGRASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2003-05-01 WO disclosed