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SCHEMBL25966202

SCHEMBL25966202

c1ccc(-c2nc(-c3ccccc3-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C53c4ccccc4-c4ccccc43)cc(-n3c4ccccc4c4ccccc43)n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ DUSP3 P51452 1/20 0.32
▸ HPGD P15428 1/20 0.31

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
SCHEMBL25121757 0.92 MAPT (0.33) MAPTTSHRNPSR1DUSP3HPGD
SCHEMBL25121544 0.91 MAPT (0.38) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL25966206 0.91 HTT (0.34) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL20199556 0.90 MAPT (0.37) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL25121567 0.89 MAPT (0.37) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL25966205 0.89 MAPT (0.35) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL25121532 0.88 DUSP3 (0.33) TSHRDUSP3
SCHEMBL25966204 0.88 MAPT (0.32) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL15832288 0.86 DUSP3 (0.33) DUSP3
SCHEMBL15840183 0.86 DUSP3 (0.32) DUSP3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 — — US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 — — US disclosed