SCHEMBL15091808

SCHEMBL15091808

COC(=O)[C@H](Cc1ccc(C(=N)NO)cc1)NC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ GAA P10253 1/20 0.51
▸ LNPEP Q9UIQ6 3/20 0.50
▸ TAS1R3 Q7RTX0 1/20 0.46
▸ TAS1R1 Q7RTX1 1/20 0.46
▸ HDAC6 Q9UBN7 5/20 0.45
▸ HDAC3 O15379 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ GLA P06280 1/20 0.45
▸ HDAC1 Q13547 5/20 0.44
▸ NOS3 P29474 1/20 0.43
▸ NOS1 P29475 1/20 0.43
▸ NOS2 P35228 1/20 0.43
▸ ERAP2 Q6P179 2/20 0.43
▸ ERAP1 Q9NZ08 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
SCHEMBL15091806 1.00 ALDH1A1 (0.51) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL15037026 0.85 CA2 (0.55) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL22756191 0.85 RAB9A (0.55) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL15019679 0.85 RAB9A (0.58) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL15018835 0.85 CA2 (0.55) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL15019680 0.85 RAB9A (0.58) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL24510641 0.84 RAB9A (0.70) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL22384136 0.82 EPHX2 (0.58) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL22384184 0.82 ROCK2 (0.45) ALDH1A1LMNARAB9AMEN1KMT2A
SCHEMBL15037142 0.82 ROCK2 (0.45) ALDH1A1LMNARAB9AMEN1KMT2A

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 11 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
EP-3230276-A1 GLP-1 RECEPTOR MODULATORS Celgene International II Sarl (CH) 2017-10-18 — — EP 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
US-9187522-B2 GLP-1 receptor modulators RECEPTOS, INC. (US) 2015-11-17 — — US disclosed
US-20150038416-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-02-05 — — US disclosed
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS LLC 2015-01-08 — — US disclosed
US-8778923-B2 GLP-1 receptor modulators RECEPTOS, INC. (US) 2014-07-15 — — US disclosed
US-20130178420-A1 NOVEL GLP-1 RECEPTOR MODULATORS RECEPTOS, INC. (US) 2013-07-11 — — 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 (6 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 ALDH1A1 4770/4885LMNA 2192/4885RAB9A 609/4885
US-20180021346-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ALDH1A1 4770/4885LMNA 2192/4885RAB9A 609/4885
US-20130178420-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ALDH1A1 4725/4885LMNA 2223/4885RAB9A 733/4885
US-20150038416-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ALDH1A1 4725/4885LMNA 2223/4885RAB9A 733/4885
US-10034886-B2 GLP-1 receptor modulators GLP1R, GIPR, GCGR ALDH1A1 4737/4885LMNA 1558/4885RAB9A 661/4885
US-20150011527-A1 NOVEL GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, NPY1R ALDH1A1 4770/4885LMNA 2192/4885RAB9A 609/4885

“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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