SCHEMBL10696499

SCHEMBL10696499

O=c1c2cccc(F)c2nc2sc(Cl)c(Cl)n12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 3/20 0.39
TRPV4 Q9HBA0 6/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MIF P14174 1/20 0.35
TRPA1 O75762 1/20 0.35
AKR1B1 P15121 1/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
PDE7B Q9NP56 1/20 0.34
PARP1 P09874 1/20 0.34
MAPT P10636 2/20 0.33

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
SCHEMBL9536458 0.86 NPC1 (0.45) PDE7ANPC1RAB9AKDM4ELMNA
SCHEMBL9533693 0.83 ELANE (0.40) PDE7ANPC1RAB9AKDM4ELMNA
SCHEMBL9533817 0.80 TNKS (0.43) KDM4EHPGDTRPA1AKR1B1PARP1
SCHEMBL10696981 0.78 PARP1 (0.38) TRPV4NPC1RAB9AKDM4ELMNA
SCHEMBL10696506 0.72 ALDH1A1 (0.62) PDE7ANPC1RAB9AKDM4EHPGD
SCHEMBL9770688 0.71 ADORA2A (0.39) TRPV4NPC1RAB9ALMNATP53
SCHEMBL10695797 0.69 KDM4E (0.52) PDE7ATRPV4KDM4ETP53HPGD
SCHEMBL9533229 0.69 PARP1 (0.40) NPC1RAB9AKDM4ELMNATP53
SCHEMBL9770496 0.69 CYP1A2 (0.43) TRPV4KDM4ELMNAHPGDSMN1; SMN2
SCHEMBL9533044 0.67 ELANE (0.40) NPC1RAB9AKDM4ELMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0263523-A2 Process for the preparation of thiazolo [2,3-b] quinazolones BASF Aktiengesellschaft (DE) 1988-04-13 EP disclosed