SCHEMBL21815414

SCHEMBL21815414

CCCCC(CC)CCc1ccc(N=Nc2ccc(-c3ccc(-c4ccc(N=Nc5ccc(CCC(CC)CCCC)cc5F)cc4)c4nsnc34)cc2)c(F)c1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ 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
SCHEMBL21815412 1.00 RARB (0.30) RARB
SCHEMBL28603156 0.94 MMP2 (0.30) —
SCHEMBL18418561 0.87 RARB (0.39) RARB
SCHEMBL21915663 0.87 — —
SCHEMBL19636613 0.83 RARB (0.36) RARB
SCHEMBL22299264 0.82 RARB (0.36) RARB
SCHEMBL21815398 0.82 — —
SCHEMBL21914656 0.82 — —
SCHEMBL21815392 0.81 MEN1 (0.34) —
SCHEMBL21815391 0.81 MEN1 (0.34) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113195684-B Azo dyes 默克专利股份有限公司 2024-10-29 — — CN disclosed
EP-3856869-A1 AZO DYE Merck Patent GmbH (DE) 2021-08-04 — — EP disclosed
CN-113195684-A Azo dyes 默克专利股份有限公司 2021-07-30 — — CN disclosed
WO-2020064591-A1 AZO DYE MERCK PATENT GMBH (DE) 2020-04-02 — — WO disclosed
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