SCHEMBL9155117

SCHEMBL9155117

Cc1cc2oc(=O)c(NC(=O)Nc3ccc(F)cc3F)c(-c3ccccc3C)c2cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL9150777 0.93 SMN1; SMN2 (0.45) NPC1RAB9AHTTSMN1; SMN2
SCHEMBL6940744 0.90 NPC1 (0.42) NPC1RAB9AHTTSMN1; SMN2
SCHEMBL9158313 0.89
SCHEMBL9153940 0.86 MAOB (0.43) NPC1RAB9ASMN1; SMN2
SCHEMBL9140427 0.86 NPC1 (0.45) NPC1RAB9AHTTSMN1; SMN2
SCHEMBL9142828 0.86 NPC1 (0.47) NPC1RAB9AHTTSMN1; SMN2
SCHEMBL9307949 0.84 TP53 (0.39) NPC1RAB9A
SCHEMBL9154452 0.84 RECQL (0.46) NPC1RAB9AHTTSMN1; SMN2
SCHEMBL9307402 0.84 PKM (0.47) NPC1RAB9AHTTSMN1; SMN2
SCHEMBL9307958 0.82 TP53 (0.39) NPC1RAB9AHTTSMN1; SMN2

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-0514546-B1 CHROMENE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-01-04 EP claimed
EP-0514546-A1 CHROMENE DERIVATIVES, THEIR PRODUCTION AND USE. TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1992-11-25 EP claimed
WO-1991012249-A1 CHROMENE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-08-22 WO claimed