SCHEMBL20041631

SCHEMBL20041631

Cc1cccc(-n2c3ccccc3c3cc(-c4cccc5c4oc4nc6ccccc6n45)ccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.40
ALDH1A1 P00352 4/20 0.37
POLB P06746 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
MAPT P10636 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
PLA2G1B P04054 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
TP53 P04637 2/20 0.35
PTGER4 P35408 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
SCHEMBL17507246 0.91 FLT3 (0.39) FLT3ALDH1A1POLBADORA3ADORA2A
SCHEMBL17507424 0.91 KDM4E (0.39) FLT3ALDH1A1POLBMAPTMEN1
SCHEMBL17507365 0.85 ALDH1A1 (0.40) FLT3ALDH1A1POLBADORA3ADORA2A
SCHEMBL17507243 0.84 FLT3 (0.38) FLT3ALDH1A1POLBMAPTMEN1
SCHEMBL20041421 0.83 TP53 (0.45) FLT3ADORA3ADORA2AADORA1MAPT
SCHEMBL20041552 0.81 NPC1 (0.41) FLT3ALDH1A1POLBADORA3ADORA2A
SCHEMBL20041533 0.81 TP53 (0.43) FLT3ADORA3ADORA2AADORA1MAPT
SCHEMBL20041679 0.81 FLT3 (0.41) FLT3ALDH1A1POLBMAPTKDM4E
SCHEMBL20041619 0.80 TP53 (0.43) FLT3MAPTSMN1; SMN2HPGDTP53
SCHEMBL9289619 0.79 PTGER4 (0.41) FLT3ALDH1A1POLBMAPTNPSR1

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