SCHEMBL26657561

SCHEMBL26657561

C=CCOC(=O)N1CCC(Oc2ccc(COc3cc4c(c(C(=O)OCC)c3)CN(C(=O)OC(C)(C)C)CC4)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 7/20 0.50
▸ PLG P00747 6/20 0.50
▸ F2 P00734 4/20 0.50
▸ PRSS1 P07477 6/20 0.46
▸ PRSS2 P07478 6/20 0.46
▸ PRSS3 P35030 6/20 0.46
▸ GPR119 Q8TDV5 4/20 0.41
▸ HPGD P15428 2/20 0.38
▸ YAP1 P46937 2/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37

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
SCHEMBL24628711 0.88 F10 (0.47) F10PLGF2PRSS1PRSS2
SCHEMBL24629039 0.87 F10 (0.48) F10PLGF2PRSS1PRSS2
SCHEMBL26657492 0.87 F10 (0.45) F10PLGF2PRSS1PRSS2
SCHEMBL24628707 0.80 F10 (0.44) F10PLGF2PRSS1PRSS2
SCHEMBL6672245 0.78 F10 (0.57) F10PLGF2PRSS1PRSS2
SCHEMBL24628709 0.77 F10 (0.43) F10PLGF2PRSS1PRSS2
SCHEMBL30670191 0.77 GPR119 (0.41) GPR119YAP1HRH3
SCHEMBL24628738 0.77 GPR119 (0.41) GPR119YAP1HRH3
SCHEMBL24628769 0.75 ESR2 (0.44) F10PLGF2PRSS1PRSS2
SCHEMBL30670212 0.74 F10 (0.41) F10PLGF2PRSS1PRSS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4276092-A1 COMPOUND LIBRARY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-15 — — EP disclosed
EP-4276092-A1 COMPOUND LIBRARY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-15 — — EP disclosed
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