SCHEMBL25008063

SCHEMBL25008063

CCCCC(C)/C(C)=N/C=C\CCc1cccc(-c2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 2/20 0.39
▸ MMP3 P08254 2/20 0.39
▸ GPR52 Q9Y2T5 2/20 0.39
▸ PTGS2 P35354 2/20 0.34
▸ MME P08473 1/20 0.34
▸ ACE P12821 1/20 0.34
▸ CPA1 P15085 1/20 0.34
▸ ACE2 Q9BYF1 1/20 0.34
▸ GPR84 Q9NQS5 1/20 0.33
▸ PTGIR P43119 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ PTGES O14684 1/20 0.33
▸ AGXT P21549 1/20 0.33
▸ DRD2 P14416 2/20 0.32
▸ OPRM1 P35372 2/20 0.32
▸ DRD3 P35462 2/20 0.32
▸ OPRD1 P41143 2/20 0.32
▸ OPRK1 P41145 2/20 0.32
▸ BCL2 P10415 1/20 0.32

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
SCHEMBL25007227 0.78 PTGIR (0.36) PTGIRPPARA
SCHEMBL30500519 0.69 PSMB5 (0.49) AGXTDRD2OPRM1DRD3OPRD1
SCHEMBL11515483 0.69 PSMB5 (0.49) AGXTDRD2OPRM1DRD3OPRD1
SCHEMBL14402816 0.69 MME (0.45) MMP2MMP3PTGS2MMEACE
SCHEMBL25008019 0.68 PNMT (0.37) OPRM1OPRD1OPRK1
SCHEMBL10599359 0.67 PSMB5 (0.48) MMP2MMP3AGXTDRD2OPRM1
SCHEMBL6059834 0.67 LPL (0.54) GPR84PPARAAGXTDRD2OPRM1
SCHEMBL3126881 0.66 LPL (0.56) PPARADRD2OPRM1DRD3OPRD1
SCHEMBL27694667 0.66 LPL (0.56) PPARADRD2OPRM1DRD3OPRD1
SCHEMBL5551488 0.66 LPL (0.53) GPR84PPARAAGXTDRD2OPRM1

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
EP-4129402-A1 HYDROXYPYRROLIDINE DERIVATIVE AND MEDICINAL APPLICATION THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2023-02-08 — — EP disclosed
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