SCHEMBL11091036

SCHEMBL11091036

COc1cc2nc(N3CCN(C(=O)C4(c5ccccc5)CCCCC4)CC3)nc(N)c2cc1OC

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 4/20 0.63
ADRA1B P35368 4/20 0.63

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
SCHEMBL11087216 1.00 ADRA1A (0.63) ADRA1AADRA1B
SCHEMBL11080069 0.99 ADRA1A (0.64) ADRA1AADRA1B
Hydrochloric Acid SCHEMBL11084847 0.98 ADRA1A (0.61) ADRA1AADRA1B
Hydrochloric Acid SCHEMBL11085370 0.97 ADRA1A (0.62) ADRA1AADRA1B
SCHEMBL11082909 0.97 ADRA1A (0.64) ADRA1AADRA1B
SCHEMBL11081283 0.95 ADRA1A (0.66) ADRA1AADRA1B
Hydrochloric Acid SCHEMBL11089652 0.94 ADRA1A (0.64) ADRA1AADRA1B
SCHEMBL7797849 0.85 ADRA1A (0.63) ADRA1AADRA1B
SCHEMBL7794600 0.84 ADRA1A (0.64) ADRA1AADRA1B
SCHEMBL11748304 0.81 ADRA1A (0.77) ADRA1AADRA1B

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
US-4426382-A HYPOTENSIVE AGENTS SANKYO COMPANY LIMITED (JP) 1984-01-17 US disclosed