SCHEMBL8102748

SCHEMBL8102748

Clc1ccc2nc(NC3CCCC3)c3nccn3c2c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 15/20 0.69

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
SCHEMBL8112512 0.99 MAPK8 (0.71) MAPK8
SCHEMBL8111037 0.86 MAPK8 (0.69) MAPK8
SCHEMBL8112516 0.85 MAPK8 (0.65) MAPK8
SCHEMBL8103022 0.85 MAPK8 (0.71) MAPK8
SCHEMBL8111186 0.84 MAPK8 (0.67) MAPK8
SCHEMBL8118642 0.83 MAPK8 (0.97) MAPK8
SCHEMBL8117091 0.81 MAPK8 (1.00) MAPK8
SCHEMBL8102950 0.81 MAPK8 (0.65) MAPK8
SCHEMBL8116949 0.77 IKBKB (0.52)
SCHEMBL8110924 0.76 KMT2A (0.52) MAPK8

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
US-6124287-A TREATING DEPRESSION BIOMEDICA FOSCAMA INDUSTRIA CHIMICOFARMACEUTICA S.P.A. (IT) 2000-09-26 US disclosed
EP-0865442-B1 IMIDAZO[1,2-a]QUINOXALIN-4-AMINES ACTIVE AS ADENOSINE ANTAGONISTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF FOSCAMA BIOMED CHIM FARMA (IT) 2000-07-05 EP disclosed