SCHEMBL8468474

SCHEMBL8468474

C[S+]([O-])c1ncc2c(n1)N(C1CC3CCC1C3)CC=C2

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.30

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
SCHEMBL3972384 0.69 HCAR1 (0.33) HCAR1
SCHEMBL5267507 0.67 CCND1 (0.59) HCAR1
SCHEMBL22860429 0.64 NUAK1 (0.40) HCAR1
SCHEMBL5868591 0.60
SCHEMBL24618839 0.57 CDK4 (0.32)
SCHEMBL5868555 0.55
SCHEMBL14811013 0.54
SCHEMBL25421857 0.54
SCHEMBL25422210 0.54
SCHEMBL25421352 0.53 HRH4 (0.30)

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-0964864-A2 PYRIDO 2,3-D] PYRIMIDINES AND 4-AMINOPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1999-12-22 EP disclosed
WO-1998033798-A2 PYRIDO[2,3-D]PYRIMIDINES AND 4-AMINO-PYRIMIDINES AS INHIBITORS OF CELL PROLIFERATION WARNER LAMBERT COMPANY (US) 1998-08-06 WO disclosed