SCHEMBL23839400

SCHEMBL23839400

CCCCCCN(CCCN)c1nc2ccc(C)cc2s1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TLR8 Q9NR97 2/20 0.42
▸ KMT2A Q03164 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ POLB P06746 2/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ APP P05067 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ PPARD Q03181 1/20 0.39
▸ MEN1 O00255 1/20 0.39

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
SCHEMBL28683905 0.83 MAPT (0.48) MAPTRAB9ANPSR1TLR8KMT2A
SCHEMBL29379396 0.83 MAPT (0.48) MAPTRAB9ANPSR1TLR8KMT2A
SCHEMBL24086141 0.76 NPSR1 (0.42) MAPTRAB9ANPSR1TLR8KMT2A
SCHEMBL13903788 0.74 APP (0.64) MAPTRAB9ANPSR1KMT2AKDM4E
SCHEMBL13903800 0.74 APP (0.64) MAPTRAB9ANPSR1KMT2AKDM4E
SCHEMBL13903795 0.74 APP (0.64) MAPTRAB9ANPSR1KMT2AKDM4E
SCHEMBL7813641 0.73 RAB9A (0.60) MAPTRAB9AKMT2AKDM4EALDH1A1
SCHEMBL21664333 0.72 NPC1 (0.50) MAPTRAB9ANPSR1KMT2AKDM4E
SCHEMBL23965747 0.72 PPARD (0.47) MAPTRAB9AKMT2AKDM4EALDH1A1
SCHEMBL14101346 0.72 HTT (0.38) MAPTRAB9ANPSR1KMT2AKDM4E

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-3604301-B1 4-PYRIDONE COMPOUND OR SALT THEREOF, AND PHARMACEUTICAL COMPOSITION AND FORMULATION INCLUDING SAME FUJIFILM CORP (JP) 2021-09-22 — — EP disclosed
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