SCHEMBL8636076

SCHEMBL8636076

O=CC1CCCN1C(=O)C1CCCCC1C(=O)OCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 8/20 0.49
▸ PREP P48147 4/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ TSHR P16473 1/20 0.44

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
SCHEMBL8635497 0.84 SPHK2 (0.53) FKBP1APREPALDH1A1CYP3A4TSHR
SCHEMBL2195118 0.81 PREP (0.56) PREPTSHR
SCHEMBL2198876 0.81 PREP (0.56) PREPTSHR
SCHEMBL2198909 0.81 PREP (0.56) PREPTSHR
SCHEMBL16347238 0.81 TSHR (0.55) FKBP1AALDH1A1TSHR
SCHEMBL17766262 0.81 TSHR (0.55) FKBP1AALDH1A1TSHR
SCHEMBL8639445 0.81 PREP (0.65) PREPTSHR
SCHEMBL8790790 0.80 SMN1; SMN2 (0.52) FKBP1APREP
SCHEMBL12490662 0.80 SMN1; SMN2 (0.52) FKBP1APREP
SCHEMBL2723657 0.80 SMN1; SMN2 (0.52) FKBP1APREP

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
US-5847155-A Aromatic pyrrolidine amide prolyl endopeptidase inhibitors PFIZER INC (US) 1998-12-08 — — US disclosed
WO-1991018891-A1 AROMATIC PYRROLIDINE AND THIAZOLIDINE AMIDES PFIZER INC. (US) 1991-12-12 — — WO disclosed
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