SCHEMBL25070427

SCHEMBL25070427

Cc1nc2c(-c3ccc(-c4ccc(CCC(C)C)cc4F)cc3)c3nsnc3c(-c3ccc(-c4ccc(CCC(C)C)cc4F)cc3)c2nc1C

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 5/20 0.37
▸ DGAT1 O75907 2/20 0.35
▸ SOAT1 P35610 2/20 0.35
▸ MAOB P27338 1/20 0.32
▸ EDNRB P24530 2/20 0.32
▸ EDNRA P25101 2/20 0.32
▸ BRS3 P32247 1/20 0.31
▸ CHKA P35790 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.30
▸ RARB P10826 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
SCHEMBL22239080 0.87 CHKA (0.34) GCGRDGAT1SOAT1BRS3CHKA
SCHEMBL25070579 0.86 ESR1 (0.33) —
SCHEMBL25070429 0.84 RARB (0.35) GCGRDGAT1SOAT1RARB
SCHEMBL25070457 0.84 — —
SCHEMBL25070667 0.81 GCGR (0.31) GCGR
SCHEMBL25070490 0.80 GRIN2D (0.32) —
SCHEMBL25070665 0.78 MAOB (0.37) MAOB
SCHEMBL25070660 0.76 EDNRB (0.35) EDNRBEDNRA
SCHEMBL25070374 0.76 SLC10A2 (0.38) —
SCHEMBL25070535 0.76 PSMB5 (0.36) MAOB

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
US-20230053362-A1 DICHROIC DYE COMPOSITION MERCK PATENT GMBH (DE) 2023-02-23 — — US disclosed
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