SCHEMBL2025920

SCHEMBL2025920

NC(=O)/C(=C/C1CC(F)C(F)C1)c1ccc(S(=O)(=O)C2CC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR6 P51684 5/20 0.37
KCNH2 Q12809 5/20 0.36
HTR2A P28223 4/20 0.36
HTR2C P28335 3/20 0.36
DRD2 P14416 3/20 0.36
ELOVL6 Q9H5J4 1/20 0.33
GCK P35557 5/20 0.33
NAMPT P43490 2/20 0.32
MMP13 P45452 1/20 0.32
CCR7 P32248 2/20 0.31
DDIT3 P35638 1/20 0.31

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
SCHEMBL2025917 1.00 CCR6 (0.37) CCR6KCNH2HTR2AHTR2CDRD2
SCHEMBL2025241 0.88 HTR2A (0.37) CCR6KCNH2HTR2AHTR2CDRD2
SCHEMBL2025243 0.88 HTR2A (0.37) CCR6KCNH2HTR2AHTR2CDRD2
SCHEMBL2513642 0.81 HTT (0.35) KCNH2HTR2AHTR2CGCKMMP13
SCHEMBL2018407 0.81 HTT (0.35) KCNH2HTR2AHTR2CGCKMMP13
SCHEMBL2018405 0.81 HTT (0.35) KCNH2HTR2AHTR2CGCKMMP13
SCHEMBL2513636 0.81 HTT (0.35) KCNH2HTR2AHTR2CGCKMMP13
SCHEMBL2513640 0.81 HTT (0.35) KCNH2HTR2AHTR2CGCKMMP13
SCHEMBL12637305 0.79 HTR2A (0.33) CCR6KCNH2HTR2AHTR2CDRD2
SCHEMBL16762636 0.76 GCK (0.63) KCNH2GCK

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 CCR6 2650/4885KCNH2 1011/4885HTR2A 1329/4885
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE GPR119, SLC5A1, SLC5A2 CCR6 2650/4885KCNH2 1011/4885HTR2A 1329/4885

“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.