SCHEMBL25070424

SCHEMBL25070424

CCCCC(CC)CC#Cc1cc2sc(-c3ccc(-c4cc5sc(C#CCC(CC)CCCC)cc5s4)c4nsnc34)cc2s1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL25070652 0.90 BDKRB2 (0.30) —
SCHEMBL25070608 0.88 — —
SCHEMBL25070670 0.88 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL25070403 0.87 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL25070333 0.85 — —
SCHEMBL25070560 0.84 ALDH1A1 (0.31) ALDH1A1LMNAPOLBHTTL3MBTL1
SCHEMBL25070337 0.83 — —
SCHEMBL25070621 0.79 — —
SCHEMBL25070541 0.79 SMN1; SMN2 (0.35) SMN1; SMN2ALDH1A1LMNAPOLBHTT
SCHEMBL21608649 0.79 SMN1; SMN2 (0.35) SMN1; SMN2ALDH1A1LMNAPOLBHTT

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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