SCHEMBL20041416

SCHEMBL20041416

Cc1ccc2oc3c(-c4ccc5oc6nc7ccccc7n6c5c4)cccc3c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
ALOX5 P09917 1/20 0.40
HPGD P15428 6/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 4/20 0.36
PIM1 P11309 1/20 0.35
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
FAAH O00519 1/20 0.34
PTPRF P10586 1/20 0.34

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
SCHEMBL20041625 0.93 NPC1 (0.41) FLT3NPC1RAB9AALOX5HPGD
SCHEMBL17507387 0.91 ALOX5 (0.49) FLT3NPC1RAB9AALOX5HPGD
SCHEMBL20041622 0.88 NPC1 (0.41) FLT3NPC1RAB9AALOX5HPGD
SCHEMBL20041681 0.87 FLT3 (0.40) FLT3NPC1RAB9AALOX5HPGD
SCHEMBL20041679 0.86 FLT3 (0.41) FLT3NPC1RAB9AALOX5HPGD
SCHEMBL20041423 0.86 NPC1 (0.42) FLT3NPC1RAB9AALOX5HPGD
SCHEMBL17507362 0.83 ALOX5 (0.50) FLT3NPC1RAB9AALOX5HPGD
SCHEMBL20041655 0.80 TP53 (0.45) NPC1RAB9AHPGDPOLBKDM4E
SCHEMBL17507420 0.80 NPC1 (0.48) NPC1RAB9AHPGDPOLBKDM4E
SCHEMBL20041474 0.79 NPC1 (0.44) FLT3NPC1RAB9AALOX5HPGD

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