SCHEMBL28201801

SCHEMBL28201801

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nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.30
AKR1C3 P42330 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
SCHEMBL5591839 0.77 ALDH1A1 (0.42) PTGS1AKR1C3
SCHEMBL5134574 0.75 PTGS1 (0.34) PTGS1AKR1C3
SCHEMBL3414053 0.75 PTGS1 (0.34) PTGS1AKR1C3
SCHEMBL503438 0.75 PTGS1 (0.34) PTGS1AKR1C3
SCHEMBL8302855 0.74
SCHEMBL34404 0.74
SCHEMBL28201803 0.74 PTGS1 (0.40) PTGS1AKR1C3
SCHEMBL149416 0.74
SCHEMBL8935075 0.72
SCHEMBL3739902 0.71 LMNA (0.33) PTGS1AKR1C3

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-107629189-A A kind of preparation and application of low-viscosity polyurethane acrylate 天津久日新材料股份有限公司 2018-01-26 CN claimed