SCHEMBL28896226

SCHEMBL28896226

Cc1c[nH]c2c(=O)[nH]c(=S)n(CC3=CC=NC=CO3)c12

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 2/20 0.31
▸ TPO P07202 2/20 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
SCHEMBL30028868 0.84 MPO (0.31) MPOTPO
SCHEMBL28896358 0.65 MPO (0.61) MPOTPO
SCHEMBL28896535 0.64 MPO (0.40) MPOTPO
SCHEMBL28896548 0.63 KMT2A (0.39) MPOTPO
SCHEMBL29211286 0.63 MPO (0.47) MPOTPO
SCHEMBL29211241 0.62 MPO (0.47) MPOTPO
SCHEMBL30029184 0.62 MPO (0.47) MPOTPO
SCHEMBL29211290 0.62 MPO (0.48) MPOTPO
SCHEMBL1536715 0.57 ALDH1A1 (0.42) MPOTPO
SCHEMBL30029124 0.53 ALDH1A1 (0.48) —

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-115403584-A 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-11-29 — — CN disclosed
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