SCHEMBL25874357

SCHEMBL25874357

Nc1ccccc1-c1ccccc1-c1nc(-c2ccccc2)nc(-c2cccc(-c3cccc(-c4nc5ccccc5s4)c3)c2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 11/20 0.56
▸ KDM4E B2RXH2 8/20 0.56
▸ NPC1 O15118 8/20 0.56
▸ MAPT P10636 7/20 0.56
▸ SMN1; SMN2 Q16637 7/20 0.56
▸ MEN1 O00255 6/20 0.56
▸ KMT2A Q03164 6/20 0.56
▸ GAA P10253 5/20 0.56
▸ ALDH1A1 P00352 4/20 0.56
▸ TDP1 Q9NUW8 3/20 0.56
▸ L3MBTL1 Q9Y468 3/20 0.56
▸ NFKB1 P19838 3/20 0.55
▸ NFKB2 Q00653 3/20 0.55
▸ RELA Q04206 3/20 0.55
▸ APP P05067 5/20 0.50
▸ POLB P06746 4/20 0.49
▸ HSD17B10 Q99714 3/20 0.49
▸ TP53 P04637 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MMP9 P14780 1/20 0.49

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
SCHEMBL25875040 1.00 RAB9A (0.56) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL25874443 0.89 RAB9A (0.67) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL25864794 0.88 RAB9A (0.56) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL25874704 0.86 KDM4E (0.70) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL19369706 0.85 RAB9A (0.65) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL26269087 0.83 APP (0.56) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL25864387 0.82 KDM4E (0.50) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL27049348 0.82 RAB9A (0.61) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL22177682 0.81 RAB9A (0.49) RAB9AKDM4ENPC1MAPTSMN1; SMN2
SCHEMBL27049351 0.81 APP (0.60) RAB9AKDM4ENPC1MAPTSMN1; 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-2023140649-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-07-27 — — WO disclosed
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