SCHEMBL20937403

SCHEMBL20937403

Cc1ccc(-c2ccc3c4ccccc4n(-c4cc(-c5cccnc5)ccc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
TP53 P04637 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP17A1 P05093 3/20 0.39
SLC2A1 P11166 1/20 0.39
CHEK1 O14757 1/20 0.37
CYP19A1 P11511 2/20 0.36
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 2/20 0.36
MAPK1 P28482 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
HTT P42858 1/20 0.36
MDM2 Q00987 1/20 0.36
PDE5A O76074 2/20 0.36
USP1 O94782 1/20 0.36
WDR48 Q8TAF3 1/20 0.36
CYP3A4 P08684 3/20 0.36
METAP2 P50579 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
SCHEMBL20937432 0.97 TP53 (0.44) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL20937435 0.94 MAPT (0.42) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL20937724 0.94 MAPT (0.41) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL20937379 0.93 MAPT (0.39) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL20937431 0.92 MAPT (0.41) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL20937438 0.92 TP53 (0.44) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL20937439 0.91 CHEK1 (0.37) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL20937368 0.90 MAPT (0.41) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL20937436 0.90 MAPT (0.38) MAPTSMN1; SMN2CYP17A1CHEK1CYP19A1
SCHEMBL20937402 0.89 MAPT (0.40) MAPTTP53NPC1RAB9ASMN1; 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
WO-2019076844-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-25 WO disclosed