SCHEMBL25966273

SCHEMBL25966273

CC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3cccc(-c4cc(-n5c6ccccc6c6ccccc65)nc(-c5ccccc5)n4)c3)c21

nearest known ligand 0.32

Predicted protein targets (top 6)

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
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
SCHEMBL25966277 0.92 MAPT (0.34) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL18564288 0.92 DUSP3 (0.32) MAPTHPGD
SCHEMBL18564365 0.91 DUSP3 (0.31) MAPTHPGD
SCHEMBL18505551 0.91 DUSP3 (0.33) TSHR
SCHEMBL18564298 0.90 MEN1 (0.32) MAPTHPGD
SCHEMBL25966204 0.90 MAPT (0.32) MAPTTSHRMAPK1NPSR1HSD17B10
SCHEMBL17879032 0.90 DUSP3 (0.31) MAPTHPGD
SCHEMBL25966469 0.90 KDM4E (0.33) TSHR
SCHEMBL25966175 0.89 MEN1 (0.32) MAPTHPGD
SCHEMBL17254142 0.89 DUSP3 (0.32) TSHR

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