SCHEMBL2019078

SCHEMBL2019078

CS(=O)(=O)c1ccc(/C(=C\C2CC(F)C(F)C2)C(=O)Nc2ccc(F)cn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCK P35557 3/20 0.47
PTGS2 P35354 4/20 0.40
AKR1C3 P42330 2/20 0.40
AKR1C2 P52895 1/20 0.40
AKR1C1 Q04828 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GPR119 Q8TDV5 1/20 0.36
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
NAMPT P43490 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
SCHEMBL2019074 1.00 GCK (0.47) GCKPTGS2AKR1C3AKR1C2AKR1C1
SCHEMBL2019842 0.89 GCK (0.46) GCKAKR1C3AKR1C2AKR1C1SIRT2
SCHEMBL2019838 0.89 GCK (0.46) GCKAKR1C3AKR1C2AKR1C1SIRT2
SCHEMBL2023882 0.87 GCK (0.47) GCKPTGS2AKR1C3AKR1C2AKR1C1
SCHEMBL2028659 0.87 GCK (0.47) GCKPTGS2AKR1C3AKR1C2AKR1C1
SCHEMBL2020259 0.87 GCK (0.45) GCKPTGS2AKR1C3KDM4E
SCHEMBL2020443 0.87 GCK (0.45) GCKPTGS2AKR1C3AKR1C2AKR1C1
SCHEMBL16633458 0.87 GCK (0.45) GCKPTGS2AKR1C3AKR1C2AKR1C1
SCHEMBL2020257 0.87 GCK (0.45) GCKPTGS2AKR1C3KDM4E
SCHEMBL2020445 0.87 GCK (0.45) GCKPTGS2AKR1C3AKR1C2AKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2275414-B1 CYCLOPENTYLACRYLAMIDE DERIVATIVE KYORIN SEIYAKU KK (JP) 2015-06-10 EP claimed
US-20110160211-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE TEIJIN LIMITED (JP) 2011-06-30 US claimed
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 GCK 188/4885PTGS2 1562/4885AKR1C3 47/4885
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE GPR119, SLC5A1, SLC5A2 GCK 188/4885PTGS2 1562/4885AKR1C3 47/4885

“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.