SCHEMBL7313380

SCHEMBL7313380

CC1(C)C=C(n2cccc(Cl)c2=O)c2ncccc2O1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32

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
SCHEMBL7292712 0.86 NPC1 (0.32) NPC1
SCHEMBL7297557 0.86 NPC1 (0.34) NPC1
SCHEMBL7298315 0.85 KDM4E (0.35) NPC1
SCHEMBL7292149 0.84 TNKS (0.31) NPC1
SCHEMBL7300660 0.83 KDM4E (0.40) NPC1
SCHEMBL7369558 0.83 NPC1 (0.34) NPC1
SCHEMBL7293126 0.82 MET (0.35) NPC1
SCHEMBL7300599 0.82
SCHEMBL7300272 0.81 NPC1 (0.33) NPC1
SCHEMBL7292929 0.81 NPBWR1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0308792-B1 AZACHROMANE DERIVATIVES MERCK PATENT GmbH (DE) 1993-07-28 EP disclosed
US-4931454-A Azachroman derivatives with effects on the cardiovascular system MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-06-05 US disclosed
EP-0308792-A2 Azachromane derivatives MERCK PATENT GmbH (DE) 1989-03-29 EP disclosed