SCHEMBL20041609

SCHEMBL20041609

Cc1cccc(-c2ccc3nc4oc5ccccc5n4c3c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.45
RAB9A P51151 7/20 0.45
TP53 P04637 5/20 0.42
MAPT P10636 4/20 0.41
HPGD P15428 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 3/20 0.38
ENPP3 O14638 2/20 0.38
POLB P06746 2/20 0.38
HSD17B10 Q99714 1/20 0.38
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAP4K4 O95819 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
KDM4E B2RXH2 3/20 0.36
CASP3 P42574 2/20 0.36
SENP8 Q96LD8 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
SENP6 Q9GZR1 2/20 0.36

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
SCHEMBL17507364 0.99 NPC1 (0.44) NPC1RAB9ATP53MAPTHPGD
SCHEMBL20041655 0.90 TP53 (0.45) NPC1RAB9ATP53MAPTHPGD
SCHEMBL17507250 0.89 TP53 (0.44) NPC1RAB9ATP53MAPTHPGD
SCHEMBL20041610 0.88 NPC1 (0.51) NPC1RAB9ATP53MAPTHPGD
SCHEMBL17507363 0.88 NPC1 (0.54) NPC1RAB9ATP53MAPTHPGD
SCHEMBL17507245 0.86 NPC1 (0.51) NPC1RAB9ATP53MAPTHPGD
SCHEMBL20041422 0.85 NPC1 (0.44) NPC1RAB9ATP53MAPTHPGD
SCHEMBL20041552 0.84 NPC1 (0.41) NPC1RAB9ATP53MAPTHPGD
SCHEMBL22357700 0.83 NPC1 (0.49) NPC1RAB9AMAPTHPGDSMN1; SMN2
SCHEMBL18701303 0.82 NPC1 (0.46) NPC1RAB9ATP53MAPTHPGD

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