SCHEMBL10696001

SCHEMBL10696001

COc1ccc(CCCNCCCC2Cc3cc(OC)c(OC)cc3C2=O)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.51

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
Hydrochloric Acid SCHEMBL10695510 0.83 BCHE (0.47) ACHE
SCHEMBL10696013 0.83 CYP3A4 (0.56) ACHE
SCHEMBL10695000 0.76 CDK8 (0.55) ACHE
Hydrochloric Acid SCHEMBL9782076 0.75 SLC2A1 (0.65)
SCHEMBL4858398 0.75 ACHE (0.56) ACHE
SCHEMBL12719136 0.75 ACHE (0.55) ACHE
Hydrochloric Acid SCHEMBL10702648 0.75 DRD2 (0.52)
SCHEMBL10695614 0.75 SMPD1 (0.46) ACHE
SCHEMBL11811971 0.74 SLC2A1 (0.68)
SCHEMBL5361048 0.74 ACHE (0.54) ACHE

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
EP-0259782-A1 Naphthalene and indane derivatives, medicaments containing these compounds and processes for their preparation Dr. Karl Thomae GmbH (DE) 1988-03-16 EP disclosed