SCHEMBL9665265

SCHEMBL9665265

COC(=O)OC1CC2CCCCC2CN1C(=O)[C@@](N)(Cc1cccc(C#N)c1)S(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 2/20 0.40
▸ F10 P00742 5/20 0.36
▸ F2 P00734 4/20 0.36
▸ USP30 Q70CQ3 1/20 0.35
▸ PIN1 Q13526 1/20 0.35
▸ PLAU P00749 1/20 0.35
▸ KAT6A Q92794 1/20 0.34
▸ ADAM17 P78536 2/20 0.34
▸ DPP4 P27487 1/20 0.34
▸ FAP Q12884 1/20 0.34
▸ DPP8 Q6V1X1 1/20 0.34
▸ DPP9 Q86TI2 1/20 0.34
▸ DPP7 Q9UHL4 1/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ MMP1 P03956 1/20 0.34

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
SCHEMBL8954772 0.89 F10 (0.40) CASRF10F2USP30PLAU
SCHEMBL8954607 0.86 CASR (0.36) CASRF10PIN1KAT6AADAM17
SCHEMBL8954944 0.84 CASR (0.38) CASRF10PIN1PLAUKAT6A
SCHEMBL9665029 0.83 CASR (0.41) CASRF10F2USP30PLAU
SCHEMBL9710115 0.80 F10 (0.37) F10F2PLAU
SCHEMBL9665283 0.80 F10 (0.48) F10F2PLAU
Hydrochloric Acid SCHEMBL9664047 0.79 F10 (0.48) F10F2PLAU
SCHEMBL8954708 0.79 CASR (0.39) CASRF10F2USP30PLAU
SCHEMBL8954993 0.78 CASR (0.41) CASRF10F2PIN1KAT6A
SCHEMBL9665755 0.77 CASR (0.38) CASRF10F2USP30PIN1

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-0511347-A1 META-SUBSTITUTED PHENYL ALANINE DERIVATIVES Pentapharm A.G. (CH) 1992-11-04 — — EP disclosed
WO-1992008709-A1 META-SUBSTITUTED PHENYL ALANINE DERIVATIVES PENTAPHARM AG (CH) 1992-05-29 — — WO disclosed
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