SCHEMBL8928656

SCHEMBL8928656

CCc1cc2c(s1)-n1c(nnc1CNC(=O)Nc1cccc(OC)c1)CN=C2c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.44
PDE4D Q08499 1/20 0.44
PKM P14618 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
CASR P41180 1/20 0.41
DGAT2 Q96PD7 1/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.40
CCKBR P32239 5/20 0.40
CCR3 P51677 1/20 0.40
AKT1 P31749 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL8928504 0.91 OPRK1 (0.56) OPRK1PDE4DPKMMAPK1RAB9A
SCHEMBL8928465 0.91 OPRK1 (0.47) OPRK1PDE4DRAB9AMAPTSMN1; SMN2
SCHEMBL8928511 0.91 PKM (0.42) PKMMAPK1RAB9ACASRDGAT2
SCHEMBL8928513 0.88 PKM (0.42) PKMMAPK1RAB9ACASRDGAT2
SCHEMBL8928545 0.85 OPRK1 (0.47) OPRK1PDE4DMAPT
SCHEMBL8928389 0.85 PKM (0.41) PKMMAPK1RAB9ACASRDGAT2
SCHEMBL8928618 0.84 OPRK1 (0.54) OPRK1PDE4DMAPK1SMN1; SMN2KMT2A
SCHEMBL8928491 0.84 OPRK1 (0.47) OPRK1PDE4DRAB9AMAPTSMN1; SMN2
SCHEMBL8928915 0.83 OPRK1 (0.62) OPRK1PDE4D
SCHEMBL8929052 0.83 OPRK1 (0.58) OPRK1PDE4DRAB9AKMT2AMEN1

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