SCHEMBL30788494

SCHEMBL30788494

S=c1[nH]nc(CSCOc2ccc(Br)c(Br)c2)[nH]1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.32
▸ MMP13 P45452 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 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
SCHEMBL29125952 1.00 LMNA (0.32) LMNAMMP13KMT2AALDH1A1HPGD
SCHEMBL30788492 0.87 LMNA (0.43) LMNAMMP13KMT2AALDH1A1
SCHEMBL29125931 0.87 LMNA (0.43) LMNAMMP13KMT2AALDH1A1
SCHEMBL29125814 0.80 SMN1; SMN2 (0.41) LMNAKMT2AALDH1A1HPGD
SCHEMBL30788508 0.79 ALDH1A1 (0.31) ALDH1A1HPGD
SCHEMBL29125882 0.79 ALDH1A1 (0.31) ALDH1A1HPGD
SCHEMBL30788471 0.78 KMT2A (0.36) MMP13KMT2AALDH1A1HPGD
SCHEMBL29125904 0.78 KMT2A (0.36) MMP13KMT2AALDH1A1HPGD
SCHEMBL29125894 0.77 GRM4 (0.36) LMNAKMT2AHPGD
SCHEMBL29128494 0.71 MTNR1B (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
CN-117247361-A Phenol-oxazolone/thioketone compound and synthetic method and application thereof 吉首大学 2023-12-19 — — CN disclosed
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