SCHEMBL22136629

SCHEMBL22136629

c1ccc(-c2nc(-c3cc(-c4ccncc4)cc(-c4ccncc4)c3)cc(-c3ccc4oc5ccccc5c4c3)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.42
▸ SMN1; SMN2 Q16637 5/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42
▸ MKNK1 Q9BUB5 1/20 0.40
▸ DHODH Q02127 1/20 0.40
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ ALDH1A1 P00352 5/20 0.39
▸ HPGD P15428 5/20 0.39
▸ NTSR1 P30989 1/20 0.39
▸ PLA2G2A P14555 2/20 0.39
▸ PLA2G4A P47712 2/20 0.39
▸ MAPK14 Q16539 1/20 0.38
▸ KDM4E B2RXH2 5/20 0.38
▸ LMNA P02545 3/20 0.38

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
SCHEMBL22136438 1.00 MAPT (0.42) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL22136542 0.99 MKNK1 (0.42) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL19166063 0.98 MKNK1 (0.41) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL19165759 0.96 MKNK1 (0.42) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL19486918 0.96 MKNK1 (0.42) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL19166526 0.96 MKNK1 (0.42) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL22136492 0.95 SMN1; SMN2 (0.40) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL22136426 0.95 MKNK1 (0.40) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL19166124 0.95 MAPT (0.44) MAPTSMN1; SMN2HSD17B10NPC1RAB9A
SCHEMBL22136434 0.94 MAPT (0.40) MAPTSMN1; SMN2HSD17B10NPC1RAB9A

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-2020130724-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 두산솔루스 주식회사 2020-06-25 — — WO disclosed
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