SCHEMBL20041655

SCHEMBL20041655

Cc1cccc(-c2ccc3oc4nc5ccccc5n4c3c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.45
MAPT P10636 3/20 0.44
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
HPGD P15428 6/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 3/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
THRB P10828 1/20 0.39
HSD17B10 Q99714 1/20 0.38
ENPP3 O14638 1/20 0.38

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
SCHEMBL17507250 0.99 TP53 (0.44) TP53MAPTNPC1RAB9AHPGD
SCHEMBL17507244 0.91 NPC1 (0.43) TP53MAPTNPC1RAB9AHPGD
SCHEMBL20041722 0.91 NPC1 (0.47) TP53MAPTNPC1RAB9AHPGD
SCHEMBL20041609 0.90 NPC1 (0.45) TP53MAPTNPC1RAB9AHPGD
SCHEMBL17507364 0.89 NPC1 (0.44) TP53MAPTNPC1RAB9AHPGD
SCHEMBL20041658 0.88 NPC1 (0.48) TP53MAPTNPC1RAB9AHPGD
SCHEMBL17507251 0.88 NPC1 (0.50) TP53MAPTNPC1RAB9AHPGD
SCHEMBL20041423 0.86 NPC1 (0.42) TP53MAPTNPC1RAB9AHPGD
SCHEMBL17507420 0.86 NPC1 (0.48) TP53MAPTNPC1RAB9AHPGD
SCHEMBL17507365 0.84 ALDH1A1 (0.40) TP53MAPTNPC1RAB9AHPGD

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