SCHEMBL20182413

SCHEMBL20182413

CCCCC(CC)Cc1ccc(-c2ccc(-c3c4nsnc4c(-c4ccc(-c5ccc(CC(C)CC)cc5)s4)c4nc(C)c(C)nc34)s2)cc1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 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
SCHEMBL20176716 0.95 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL21241718 0.87 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL19798700 0.86 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL18217182 0.86 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL18217156 0.86 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL20176730 0.82 KDM4E (0.31) —
SCHEMBL21019972 0.81 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL18217189 0.81 BDKRB2 (0.33) SMN1; SMN2
SCHEMBL18217130 0.80 ESR1 (0.30) —
SCHEMBL25070455 0.80 PTPRF (0.33) —

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-10738240-B2 Thiadiazoloquinoxaline derivatives MERCK PATENT GMBH (DE) 2020-08-11 — — US disclosed
US-20180142153-A1 THIADIAZOLOQUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-05-24 — — US disclosed
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