SCHEMBL17834709

SCHEMBL17834709

CC(C)(C)OC(=O)[C@H](Cc1ccc(-c2ncc(-c3ccc(OS(=O)(=O)C(F)(F)F)cc3F)cn2)cc1)NC(=O)c1ccc(C(C)(C)C)s1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
ROCK2 O75116 2/20 0.36
MAPT P10636 6/20 0.36
TDP1 Q9NUW8 4/20 0.36
POLB P06746 3/20 0.36
NPSR1 Q6W5P4 3/20 0.35
ATM Q13315 1/20 0.35
MLYCD O95822 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
BCL2 P10415 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RECQL P46063 1/20 0.33
PAX8 Q06710 1/20 0.33
PTPN1 P18031 1/20 0.33

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
SCHEMBL22384086 1.00 ALOX5AP (0.38) ALOX5APFEN1ROCK2MAPTTDP1
SCHEMBL17834699 0.93 ALOX5AP (0.40) ALOX5APFEN1ROCK2TDP1BCL2
SCHEMBL17825510 0.93 MCL1 (0.38) ALOX5APFEN1PTPN1
SCHEMBL17825512 0.93 MCL1 (0.38) ALOX5APFEN1PTPN1
SCHEMBL22384218 0.91 CTSS (0.35) ALOX5APFEN1MAPTTDP1BCL2
SCHEMBL22367910 0.89 MCL1 (0.34) ALOX5APFEN1
SCHEMBL17825473 0.89 MCL1 (0.34) ALOX5APFEN1
SCHEMBL17834410 0.89 P2RX7 (0.34) ALOX5APFEN1
SCHEMBL22384234 0.88 LY96 (0.40) ALOX5APFEN1ROCK2MAPTTDP1
SCHEMBL17834723 0.88 LY96 (0.40) ALOX5APFEN1ROCK2MAPTTDP1

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
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
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 ALOX5AP 3115/4885FEN1 3722/4885ROCK2 1468/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ALOX5AP 3115/4885FEN1 3722/4885ROCK2 1468/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR ALOX5AP 3438/4885FEN1 3634/4885ROCK2 1466/4885

“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.