SCHEMBL2022436

SCHEMBL2022436

CS(=O)(=O)c1ccc(/C(=C\C2CC(F)C(F)C2)C(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 13/20 0.55
PTGS2 P35354 5/20 0.52
AKR1C2 P52895 3/20 0.52
AKR1C1 Q04828 3/20 0.52

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
SCHEMBL2022434 1.00 AKR1C3 (0.55) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2024349 0.86 AKR1C3 (0.40) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2024348 0.86 AKR1C3 (0.40) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2026091 0.85 AKR1C3 (0.42) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2026092 0.85 AKR1C3 (0.42) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2025241 0.84 HTR2A (0.37) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2025243 0.84 HTR2A (0.37) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL12574527 0.83 AKR1C3 (0.38) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2646494 0.83 AKR1C3 (0.57) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2646492 0.83 AKR1C3 (0.57) AKR1C3PTGS2AKR1C2AKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9452977-B2 Cyclopentylacrylamide derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2016-09-27 US disclosed
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE TEIJIN LIMITED (JP) 2015-04-16 US disclosed
US-8946440-B2 Cyclopentylacrylamide derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2015-02-03 US disclosed
US-20110160211-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE TEIJIN LIMITED (JP) 2011-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110160211-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE GPR119, SLC5A1, SLC5A2 AKR1C3 47/4885PTGS2 1562/4885AKR1C2 58/4885
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE GPR119, SLC5A1, SLC5A2 AKR1C3 47/4885PTGS2 1562/4885AKR1C2 58/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.