SCHEMBL2021786

SCHEMBL2021786

CS(=O)(=O)c1ccc(/C(=C\[C@H]2C[C@@H](F)[C@@H](F)C2)C(=O)Nc2ccn(C[C@H](O)CO)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCK P35557 11/20 0.40
KCNH2 Q12809 1/20 0.34
RORC P51449 1/20 0.33
EPHX2 P34913 1/20 0.30
AXL P30530 1/20 0.30
TYRO3 Q06418 1/20 0.30
MERTK Q12866 1/20 0.30

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
SCHEMBL2020801 1.00 GCK (0.40) GCKKCNH2RORCEPHX2AXL
SCHEMBL2021788 1.00 GCK (0.40) GCKKCNH2RORCEPHX2AXL
SCHEMBL2020799 1.00 GCK (0.40) GCKKCNH2RORCEPHX2AXL
SCHEMBL2021979 0.90 GCK (0.34) GCKKCNH2RORC
SCHEMBL16762643 0.90 GCK (0.34) GCKKCNH2RORC
SCHEMBL2020436 0.90 GCK (0.34) GCKKCNH2RORC
SCHEMBL16762634 0.90 GCK (0.34) GCKKCNH2RORC
SCHEMBL2021503 0.88 GCK (0.42) GCKKCNH2EPHX2
SCHEMBL2021506 0.88 GCK (0.42) GCKKCNH2EPHX2
SCHEMBL2018439 0.88 GCK (0.45) GCKKCNH2EPHX2

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 188/4885KCNH2 1011/4885RORC 4173/4885
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE GPR119, SLC5A1, SLC5A2 GCK 188/4885KCNH2 1011/4885RORC 4173/4885

“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.