SCHEMBL25757947

SCHEMBL25757947

COc1ccc2nc3cc(N)ccc3c(N)c2c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.74
MEN1 O00255 3/20 0.72
KMT2A Q03164 3/20 0.72
BLM P54132 2/20 0.72
TERT O14746 1/20 0.72
ABCB11 O95342 1/20 0.72
LMNA P02545 1/20 0.72
THRB P10828 1/20 0.72
CASP7 P55210 2/20 0.58
KDM4E B2RXH2 2/20 0.58
ALDH1A1 P00352 1/20 0.58
MAPT P10636 1/20 0.58
HPGD P15428 1/20 0.58
MAPK1 P28482 1/20 0.58
CASP1 P29466 1/20 0.58
HSD17B10 Q99714 1/20 0.58
MYC P01106 1/20 0.57
CGAS Q8N884 1/20 0.53
ACHE P22303 5/20 0.52
BCHE P06276 4/20 0.52

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
SCHEMBL18190080 0.85 APP (0.55) APPMEN1KMT2ABLMTERT
SCHEMBL29445571 0.85 APP (0.70) APPMEN1KMT2ABLMTERT
SCHEMBL29365544 0.85 APP (0.70) APPMEN1KMT2ABLMTERT
SCHEMBL106725 0.85 APP (0.70) APPMEN1KMT2ABLMTERT
SCHEMBL12488031 0.85 APP (0.70) APPMEN1KMT2ABLMTERT
SCHEMBL28041997 0.84 APP (0.68) APPMEN1KMT2ABLMTERT
Ethacridine SCHEMBL193949 0.84 MEN1 (1.00) APPMEN1KMT2ABLMTERT
Ethacridine SCHEMBL11662539 0.84 MEN1 (1.00) APPMEN1KMT2ABLMTERT
Ethacridine SCHEMBL29456272 0.84 MEN1 (1.00) APPMEN1KMT2ABLMTERT
Ethacridine SCHEMBL30310148 0.84 MEN1 (1.00) APPMEN1KMT2ABLMTERT

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-2023116397-A1 INNATE IMMUNE-ACTIVATING DRUG AND USE THEREOF 珞达生物医药(苏州)有限公司 2023-06-29 WO disclosed