SCHEMBL6515262

SCHEMBL6515262

N=C(NO)c1ccc(NC(=O)c2ccccc2)nc1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 1/20 0.70
DEGS1 O15121 1/20 0.56
RAB9A P51151 11/20 0.55
KMT2A Q03164 6/20 0.55
KDM4E B2RXH2 2/20 0.55
NPC1 O15118 10/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPT P10636 1/20 0.52
MEN1 O00255 5/20 0.51
RXFP1 Q9HBX9 1/20 0.51
POLB P06746 1/20 0.51
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL14973431 0.84 HCAR3 (0.47) HCAR3DEGS1RAB9AKDM4ESMN1; SMN2
SCHEMBL28102450 0.84 HCAR3 (0.72) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL2664544 0.83 HCAR3 (1.00) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL1792974 0.81 GCK (0.78) KMT2AMEN1
SCHEMBL11308749 0.80 HCAR3 (0.77) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL4409319 0.80 PTK2 (0.54) HCAR3RAB9AKMT2AKDM4ESMN1; SMN2
SCHEMBL26986641 0.79 GRM5 (0.52) HCAR3DEGS1RAB9AKMT2ANPC1
SCHEMBL1558817 0.78 RAB9A (0.79) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL31241065 0.78 RAB9A (0.79) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL2664558 0.78 HCAR3 (0.68) HCAR3DEGS1RAB9AKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1568367-A1 Compounds effecting glucokinase AstraZeneca AB (SE) 2005-08-31 EP disclosed
EP-1529530-A1 Compounds affecting glucokinase AstraZeneca AB (SE) 2005-05-11 EP disclosed