SCHEMBL21185812

SCHEMBL21185812

CCN1C(=O)C(=C2Sc3c(O)cc(Br)c(O)c3S2)C(=O)N1CC

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CGAS Q8N884 5/20 0.36
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ PKM P14618 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 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
SCHEMBL21185808 0.77 — —
SCHEMBL21185799 0.72 TYR (0.36) CGASMEN1KMT2AALDH1A1MAPT
SCHEMBL21185510 0.69 CISD1 (0.33) —
SCHEMBL21185802 0.67 TXNRD1 (0.31) ALDH1A1
SCHEMBL21185464 0.67 TYR (0.35) MEN1KMT2APKMALDH1A1MAPT
SCHEMBL21185805 0.67 — —
SCHEMBL21185416 0.65 MGLL (0.39) ALDH1A1
SCHEMBL13777421 0.64 MEN1 (0.43) MEN1KMT2APKMALDH1A1LMNA
SCHEMBL21185519 0.63 — —
SCHEMBL21185523 0.62 AURKA (0.31) —

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
WO-2019142538-A1 COMPOSITION, CURABLE COMPOSITION, AND COMPOUND 富士フイルム株式会社 2019-07-25 — — WO disclosed
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