SCHEMBL27486147

SCHEMBL27486147

O=C(N1Cc2cccnc2Nc2ccccc21)N1Cc2cccnc2Nc2ccccc21

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 20/20 0.73

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
SCHEMBL17806720 0.85 IDH1 (1.00) IDH1
SCHEMBL22006155 0.84 IDH1 (0.72) IDH1
SCHEMBL22006165 0.84 IDH1 (0.70) IDH1
SCHEMBL17806760 0.84 IDH1 (0.80) IDH1
SCHEMBL17807045 0.84 IDH1 (1.00) IDH1
SCHEMBL4150867 0.83 IDH1 (0.62) IDH1
SCHEMBL22184435 0.83 IDH1 (1.00) IDH1
SCHEMBL19741925 0.83 IDH1 (1.00) IDH1
SCHEMBL17806793 0.83 IDH1 (1.00) IDH1
SCHEMBL19713522 0.82 IDH1 (1.00) IDH1

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
CN-1162429-C Tricyclic vasopressin agonists 2004-08-18 CN disclosed
CN-1347415-A Tricyclic pyridine N-oxide vasopressin agonists AMERICAN HOME PROD (US) 2002-05-01 CN disclosed