SCHEMBL20041411

SCHEMBL20041411

c1ccc2c(c1)nc1oc3c(-c4ccc5[nH]c6ccccc6c5c4)cccc3n12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.36
FLT3 P36888 3/20 0.35
BMX P51813 2/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
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
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35
GABRA4 P48169 1/20 0.35
GABRE P78334 1/20 0.35
GABRA6 Q16445 1/20 0.35
GABRG1 Q8N1C3 1/20 0.35
GABRG3 Q99928 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
SCHEMBL20735396 0.83 FLT3 (0.37) FLT3BMXNPC1RAB9AMAPT
SCHEMBL20697969 0.82 FLT3 (0.36) FLT3BMXNPC1RAB9AMAPT
SCHEMBL17507386 0.82 NPC1 (0.41) FLT3BMXNPC1RAB9AAHR
SCHEMBL20041739 0.82 NPC1 (0.44) TOP2ANPC1RAB9AGABRPGABRD
SCHEMBL17507243 0.81 FLT3 (0.38) FLT3BMXNPC1RAB9AMAPT
SCHEMBL17507424 0.79 KDM4E (0.39) FLT3BMXNPC1RAB9AMAPT
SCHEMBL17507335 0.78 HPGD (0.39) FLT3BMXNPC1RAB9AMAPT
SCHEMBL17507336 0.78 HPGD (0.40) FLT3NPC1RAB9AMAPTHPGD
SCHEMBL17507333 0.78 HPGD (0.42) NPC1RAB9AMAPTHPGDALDH1A1
SCHEMBL20041679 0.77 FLT3 (0.41) FLT3BMXNPC1RAB9AMAPT

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