SCHEMBL17507331

SCHEMBL17507331

Cc1ccc2c(c1)c1cc(-c3ccc4nc5oc6ccccc6n5c4c3)ccc1n2-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 5/20 0.36
KMT2A Q03164 3/20 0.36
PDE10A Q9Y233 3/20 0.36
MAPK1 P28482 2/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35

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
SCHEMBL20041731 0.92 NPC1 (0.40) NPC1RAB9AALDH1A1KMT2APDE10A
SCHEMBL17507332 0.91 NPC1 (0.49) NPC1RAB9AALDH1A1KMT2APDE10A
SCHEMBL20041552 0.90 NPC1 (0.41) NPC1RAB9AALDH1A1KMT2AMAPK1
SCHEMBL20041422 0.86 NPC1 (0.44) NPC1RAB9AALDH1A1MAPK1KDM4E
SCHEMBL17507388 0.83 NPC1 (0.46) NPC1RAB9AALDH1A1KMT2AMAPK1
SCHEMBL17507365 0.82 ALDH1A1 (0.40) NPC1RAB9AALDH1A1KMT2AMAPK1
SCHEMBL20041609 0.81 NPC1 (0.45) NPC1RAB9AALDH1A1KMT2AKDM4E
SCHEMBL17507245 0.80 NPC1 (0.51) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL20041550 0.80 NPC1 (0.48) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL17507379 0.80 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 2 patents. 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
EP-2982676-A1 Benzimidazo[2,1-B]benzoxazoles for electronic applications Idemitsu Kosan Co., Ltd. (JP) 2016-02-10 EP disclosed