SCHEMBL8928389

SCHEMBL8928389

COc1cccc(NC(=O)NCc2nnc3n2-c2sc(C)c(C)c2C(c2ccccc2)=NC3)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
CASR P41180 1/20 0.41
CCR3 P51677 2/20 0.41
MAPT P10636 4/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
AKT1 P31749 1/20 0.39
BRD4 O60885 1/20 0.39
DGAT2 Q96PD7 1/20 0.39
KMT2A Q03164 1/20 0.39
KIT P10721 1/20 0.38
KDR P35968 1/20 0.38
TEK Q02763 1/20 0.38
HTR2A P28223 1/20 0.38
IDO1 P14902 1/20 0.38
CCKBR P32239 3/20 0.38
NAMPT P43490 1/20 0.38

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
SCHEMBL8928620 0.91 SMN1; SMN2 (0.40) RAB9AMAPTSMN1; SMN2BRD4KMT2A
SCHEMBL8928511 0.88 PKM (0.42) PKMMAPK1RAB9ACASRCCR3
SCHEMBL8928656 0.85 OPRK1 (0.44) PKMMAPK1RAB9ACASRCCR3
SCHEMBL8928513 0.85 PKM (0.42) PKMMAPK1RAB9ACASRCCR3
SCHEMBL8928425 0.83 MAPK1 (0.44) MAPK1SMN1; SMN2BRD4KMT2A
SCHEMBL8928635 0.79 PTAFR (0.44) PKMMAPK1RAB9ACASRMAPT
SCHEMBL8928437 0.79 HPGD (0.41) RAB9AMAPTSMN1; SMN2AKT1CCKBR
SCHEMBL8928545 0.78 OPRK1 (0.47) MAPT
SCHEMBL8928504 0.78 OPRK1 (0.56) PKMMAPK1RAB9AKMT2A
SCHEMBL8928465 0.77 OPRK1 (0.47) RAB9AMAPTSMN1; SMN2AKT1KMT2A

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-0776892-A1 THIENYLAZOLE COMPOUND AND THIENOTRIAZOLODIAZEPINE COMPOUND YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-06-04 EP disclosed