SCHEMBL25864794

SCHEMBL25864794

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3cccc(-c4cccc(-c5nc6ccccc6s5)c4)c3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 10/20 0.56
▸ KDM4E B2RXH2 10/20 0.56
▸ SMN1; SMN2 Q16637 7/20 0.56
▸ MAPT P10636 7/20 0.56
▸ NPC1 O15118 7/20 0.56
▸ ALDH1A1 P00352 6/20 0.56
▸ NFKB1 P19838 5/20 0.56
▸ NFKB2 Q00653 5/20 0.56
▸ RELA Q04206 5/20 0.56
▸ MEN1 O00255 4/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ LMNA P02545 4/20 0.56
▸ HSD17B10 Q99714 3/20 0.56
▸ POLB P06746 2/20 0.56
▸ TP53 P04637 2/20 0.56
▸ TDP1 Q9NUW8 3/20 0.52
▸ APP P05067 3/20 0.50
▸ MMP9 P14780 1/20 0.49
▸ MMP8 P22894 1/20 0.49
▸ DUSP3 P51452 1/20 0.47

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
SCHEMBL25864387 0.89 KDM4E (0.50) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL27049348 0.89 RAB9A (0.61) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL19369706 0.89 RAB9A (0.65) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL22177681 0.88 RAB9A (0.52) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL25874598 0.88 MEN1 (0.44) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL25874704 0.88 KDM4E (0.70) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL22177682 0.88 RAB9A (0.49) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL25875040 0.88 RAB9A (0.56) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL25874357 0.88 RAB9A (0.56) RAB9AKDM4ESMN1; SMN2MAPTNPC1
SCHEMBL22177680 0.87 RAB9A (0.51) RAB9AKDM4ESMN1; SMN2MAPTNPC1

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-2023136586-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-07-20 — — WO disclosed
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