SCHEMBL17968982

SCHEMBL17968982

CCC1CCC(c2ccc(-c3cnc(-c4ccc(CC(NC(=O)c5ccc(C(C)(C)C)s5)C(=O)N5CC(C(=O)OC)C5)cc4)nc3)cc2)CC1

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.32
▸ CCR1 P32246 2/20 0.32
▸ DGAT1 O75907 2/20 0.32
▸ PRCP P42785 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ F10 P00742 2/20 0.31
▸ ITGB3 P05106 1/20 0.31
▸ ITGA2B P08514 1/20 0.31
▸ PLAU P00749 2/20 0.31
▸ ITGA4 P13612 1/20 0.31
▸ ITGB7 P26010 1/20 0.31
▸ ACACB O00763 2/20 0.31
▸ FPR2 P25090 1/20 0.31
▸ PLG P00747 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 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
SCHEMBL17968980 1.00 F2 (0.32) F2CCR1DGAT1PRCPS1PR1
SCHEMBL17968978 1.00 F2 (0.32) F2CCR1DGAT1PRCPS1PR1
SCHEMBL19465501 0.94 S1PR1 (0.34) F2CCR1DGAT1PRCPS1PR1
SCHEMBL17834690 0.94 S1PR1 (0.34) F2CCR1DGAT1PRCPS1PR1
SCHEMBL17968825 0.94 S1PR1 (0.34) F2CCR1DGAT1PRCPS1PR1
SCHEMBL19481390 0.91 PRCP (0.33) F2CCR1DGAT1PRCPITGB3
SCHEMBL17834847 0.91 CCR1 (0.36) F2CCR1DGAT1PRCPS1PR1
SCHEMBL17968907 0.89 ALDH1A1 (0.37) CCR1DGAT1PRCPS1PR1ITGA4
SCHEMBL17968905 0.89 ALDH1A1 (0.37) CCR1DGAT1PRCPS1PR1ITGA4
SCHEMBL17834467 0.89 ALDH1A1 (0.37) CCR1DGAT1PRCPS1PR1ITGA4

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 5 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-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-20160228450-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2016-08-11 — — 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 (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 F2 1854/4885CCR1 1296/4885DGAT1 2899/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R F2 1854/4885CCR1 1296/4885DGAT1 2899/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR F2 1388/4885CCR1 1102/4885DGAT1 2729/4885

“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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