SCHEMBL17834856

SCHEMBL17834856

CC(C)(C)c1ccc(C(=O)N[C@@H](Cc2ccc(-c3ncc(-c4ccc(-c5cccc(C(F)(F)F)c5)cc4)cn3)cc2)C(=O)O)s1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KIFC1 Q9BW19 11/20 0.60
▸ GPR34 Q9UPC5 1/20 0.49
▸ MCL1 Q07820 4/20 0.48
▸ ITGB1 P05556 1/20 0.48
▸ ITGA4 P13612 1/20 0.48
▸ ITGB7 P26010 1/20 0.48
▸ CDK2 P24941 1/20 0.47
▸ GPR132 Q9UNW8 1/20 0.43
▸ MME P08473 1/20 0.43

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
SCHEMBL17968913 0.92 KIFC1 (0.49) KIFC1MCL1ITGB1ITGA4ITGB7
SCHEMBL15036992 0.92 KIFC1 (0.49) KIFC1MCL1ITGB1ITGA4ITGB7
SCHEMBL17834526 0.92 KIFC1 (0.49) KIFC1MCL1ITGB1ITGA4ITGB7
SCHEMBL17995223 0.92 KIFC1 (0.52) KIFC1GPR34MCL1ITGB1ITGA4
SCHEMBL22384495 0.90 KIFC1 (0.50) KIFC1GPR34MCL1ITGB1ITGA4
SCHEMBL22449054 0.89 KIFC1 (0.48) KIFC1MCL1ITGB1ITGA4ITGB7
SCHEMBL15037327 0.89 KIFC1 (0.48) KIFC1MCL1ITGB1ITGA4ITGB7
SCHEMBL15037392 0.88 KIFC1 (0.43) KIFC1MCL1ITGB1ITGA4ITGB7
SCHEMBL17968745 0.88 KIFC1 (0.43) KIFC1MCL1ITGB1ITGA4ITGB7
SCHEMBL17834867 0.88 KIFC1 (0.43) KIFC1MCL1ITGB1ITGA4ITGB7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3230276-B1 GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-09-02 — — EP disclosed
US-10034886-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2018-07-31 — — US disclosed
US-10034886-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2018-07-31 — — US disclosed
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2018-01-25 — — US disclosed
US-9795613-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-10-24 — — US disclosed
US-9795613-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-10-24 — — US disclosed
US-20160228450-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2016-08-11 — — US disclosed
WO-2016094729-A1 GLP-1 RECEPTOR MODULATORS CELGENE INTERNATIONAL II SARL (CH) 2016-06-16 — — WO 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 (3 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-20160228450-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R KIFC1 4738/4885GPR34 115/4885MCL1 2102/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R KIFC1 4738/4885GPR34 115/4885MCL1 2102/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR KIFC1 4749/4885GPR34 132/4885MCL1 1664/4885

“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.

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