SCHEMBL9178654

SCHEMBL9178654

C=CC(=CC)C1=NCCN1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 12/20 0.41
HTR1D P28221 1/20 0.30
ADRA1A P35348 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
SCHEMBL6064763 0.70
SCHEMBL223938 0.69
SCHEMBL15615254 0.67 NISCH (0.44) NISCH
SCHEMBL3617453 0.63
SCHEMBL2726339 0.61
SCHEMBL2530611 0.61
SCHEMBL4608595 0.60
SCHEMBL12569541 0.59 NISCH (0.44) NISCH
SCHEMBL705194 0.58 ADRA2B (0.31) NISCH
SCHEMBL8020035 0.58 ALDH1A1 (0.36) NISCH

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-0451508-B1 Process for preparing homo- and copolymers of monoethyleically unsaturated dicarboxylic acids and their use BASF AG (DE) 1995-06-07 EP disclosed
EP-0451508-A1 Process for preparing homo- and copolymers of monoethyleically unsaturated dicarboxylic acids and their use BASF Aktiengesellschaft (DE) 1991-10-16 EP disclosed