SCHEMBL25966187

SCHEMBL25966187

CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cccc(-c5cc(-n6c7ccccc7c7ccccc76)nc(-c6ccccc6)n5)c4)c3cc21

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ HPGD P15428 2/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ LMNA P02545 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GLA P06280 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL25966261 0.96 MAPT (0.33) MAPTTSHRMAPK1HSD17B10NPSR1
SCHEMBL15257550 0.94 MEN1 (0.34) MAPTHPGDKDM4EATML3MBTL1
SCHEMBL802559 0.94 PTGER4 (0.34) MAPTTSHRMAPK1HSD17B10NPSR1
SCHEMBL15257576 0.93 MEN1 (0.36) MAPTNPSR1HPGDKDM4EATM
SCHEMBL14731161 0.92 MAPT (0.39) MAPTTSHRMAPK1HSD17B10NPSR1
SCHEMBL25966192 0.91 MAPT (0.35) MAPTTSHRMAPK1HSD17B10NPSR1
SCHEMBL18564308 0.91 KDM4E (0.34) MAPTHPGDKDM4EATML3MBTL1
SCHEMBL15806132 0.91 MAPT (0.34) MAPTTSHRMAPK1HSD17B10NPSR1
SCHEMBL18564568 0.91 — —
SCHEMBL18564278 0.90 KDM4E (0.33) MAPTHPGDKDM4EATML3MBTL1

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
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