SCHEMBL29128532

SCHEMBL29128532

O=c1[nH]cc(CSCCCOc2cc(Br)ccc2Br)o1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 1/20 0.30
▸ CYSLTR1 Q9Y271 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
SCHEMBL29128218 0.86 LMNA (0.33) CYSLTR2CYSLTR1
SCHEMBL29128384 0.84 HTR1B (0.36) —
SCHEMBL29128590 0.83 MAOB (0.35) —
SCHEMBL29128388 0.78 NR3C2 (0.34) —
SCHEMBL29128420 0.77 MEN1 (0.40) —
SCHEMBL29128179 0.76 ALDH1A1 (0.42) —
SCHEMBL30799894 0.75 RAB9A (0.46) —
SCHEMBL29128337 0.75 RAB9A (0.46) —
SCHEMBL29128446 0.74 SMN1; SMN2 (0.39) —
SCHEMBL30799968 0.73 MAOA (0.35) —

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-117263862-A Phenol-1, 3-oxazole/dihydroimidazole-2-ketone/thioketone compound and synthesis and application thereof 吉首大学 2023-12-22 — — CN disclosed
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