SCHEMBL2017115

SCHEMBL2017115

COCCOc1cnc(NC(=O)/C(=C/[C@H]2C[C@@H](F)[C@@H](F)C2)c2ccc(S(=O)(=O)C3CC3)cc2)cn1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCK P35557 14/20 0.40
CCR6 P51684 2/20 0.34
NAMPT P43490 1/20 0.34
PRKAA2 P54646 2/20 0.33
KCNH2 Q12809 3/20 0.31
CDK1 P06493 1/20 0.31
CDK4 P11802 1/20 0.31
CDK2 P24941 1/20 0.31
KDR P35968 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
SCHEMBL2017118 1.00 GCK (0.40) GCKCCR6NAMPTPRKAA2KCNH2
SCHEMBL2024523 0.96 GCK (0.39) GCKCCR6NAMPTPRKAA2KCNH2
SCHEMBL2024522 0.96 GCK (0.39) GCKCCR6NAMPTPRKAA2KCNH2
SCHEMBL2019938 0.93 GCK (0.38) GCKCCR6PRKAA2KCNH2
SCHEMBL1024633 0.93 GCK (0.38) GCKCCR6PRKAA2KCNH2
SCHEMBL1025560 0.92 GCK (0.39) GCKCCR6PRKAA2KCNH2
SCHEMBL2026821 0.92 GCK (0.39) GCKCCR6PRKAA2KCNH2
SCHEMBL2019241 0.91 GCK (0.42) GCKNAMPTKCNH2
SCHEMBL2019244 0.91 GCK (0.42) GCKNAMPTKCNH2
SCHEMBL2027043 0.91 GCK (0.40) GCKCCR6PRKAA2KCNH2

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 7 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-8946440-B2 Cyclopentylacrylamide derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2015-02-03 US 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 188/4885CCR6 2650/4885NAMPT 2062/4885
US-20150105581-A1 CYCLOPENTYLACRYLAMIDE DERIVATIVE GPR119, SLC5A1, SLC5A2 GCK 188/4885CCR6 2650/4885NAMPT 2062/4885

“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.