SCHEMBL20041708

SCHEMBL20041708

Cn1c2ccc(-c3ccc4oc5c(-c6ccc7c(c6)n6c8ccccc8nc6n7-c6ccc7nc8oc9ccccc9n8c7c6)cccc5c4c3)cc2n2c3ccccc3nc12

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ALOX5 P09917 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
SCHEMBL17507338 0.91 NPC1 (0.36) NPC1RAB9A
SCHEMBL20041709 0.88 NPC1 (0.32) NPC1RAB9AALOX5
SCHEMBL17507380 0.88 NPC1 (0.38) NPC1RAB9A
SCHEMBL17507252 0.87 NPC1 (0.36) NPC1RAB9A
SCHEMBL17507337 0.87 NPC1 (0.36) NPC1RAB9A
SCHEMBL20041537 0.87 NPC1 (0.37) NPC1RAB9A
SCHEMBL20041529 0.86 NPC1 (0.35) NPC1RAB9A
SCHEMBL17507381 0.86 NPC1 (0.36) NPC1RAB9A
SCHEMBL20041684 0.85 ALOX5 (0.40) NPC1RAB9AALOX5
SCHEMBL17507379 0.85 NPC1 (0.37) NPC1RAB9A

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-2982676-B1 Benzimidazo[2,1-B]benzoxazoles for electronic applications IDEMITSU KOSAN CO (JP) 2018-04-11 EP disclosed