SCHEMBL20041619

SCHEMBL20041619

Cc1cccc(-c2ccc(-c3cccc4c3oc3nc5ccccc5n34)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.43
ENPP3 O14638 2/20 0.42
MAPT P10636 7/20 0.40
FLT3 P36888 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
THRB P10828 1/20 0.37
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 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
SCHEMBL20041533 0.94 TP53 (0.43) TP53ENPP3MAPTFLT3RXFP1
SCHEMBL20041421 0.94 TP53 (0.45) TP53ENPP3MAPTFLT3RXFP1
SCHEMBL17507339 0.90 FLT3 (0.45) TP53MAPTFLT3TDP1THRB
SCHEMBL17507336 0.89 HPGD (0.40) TP53MAPTFLT3NPC1HPGD
SCHEMBL17507335 0.86 HPGD (0.39) TP53MAPTFLT3NPC1HPGD
SCHEMBL17507333 0.86 HPGD (0.42) TP53MAPTNPC1HPGDRAB9A
SCHEMBL20041679 0.82 FLT3 (0.41) TP53MAPTFLT3TDP1NPC1
SCHEMBL20041655 0.81 TP53 (0.45) TP53ENPP3MAPTRXFP1THRB
SCHEMBL17507250 0.81 TP53 (0.44) TP53ENPP3MAPTRXFP1THRB
SCHEMBL20041631 0.80 FLT3 (0.40) TP53MAPTFLT3HPGDSMN1; 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 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