SCHEMBL14729010

SCHEMBL14729010

CC(C)(O)CCCS(=O)(=O)N1CC=C(c2ccc3nc(OC4CCN(C(=O)OCC5CCC5)CC4)sc3c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.40
ACACB O00763 2/20 0.34
LIPC P11150 3/20 0.33
LIPG Q9Y5X9 3/20 0.33
ADAM10 O14672 2/20 0.32
JAK1 P23458 1/20 0.31
ENPP2 Q13822 1/20 0.31
MMP2 P08253 2/20 0.31
MMP3 P08254 2/20 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
SCHEMBL14729007 0.96 GPR119 (0.40) GPR119ACACBLIPCLIPGADAM10
SCHEMBL14729014 0.91 GPR119 (0.40) GPR119ACACBADAM10JAK1ENPP2
SCHEMBL14729016 0.90 GPR119 (0.40) GPR119ACACBADAM10JAK1ENPP2
SCHEMBL14729000 0.89 GPR119 (0.49) GPR119ACACBLIPCLIPG
SCHEMBL14728964 0.87 GPR119 (0.40) GPR119ACACBLIPCLIPGADAM10
SCHEMBL14728966 0.86 GPR119 (0.41) GPR119ACACBLIPCLIPGJAK1
SCHEMBL14728998 0.85 GPR119 (0.50) GPR119ACACBLIPCLIPG
SCHEMBL14728983 0.85 GPR119 (0.41) GPR119ACACBLIPCLIPGJAK1
SCHEMBL14729163 0.85 GPR119 (0.40) GPR119ACACBLIPCLIPGJAK1
SCHEMBL14729173 0.84 GPR119 (0.37) GPR119ACACBLIPCLIPGJAK1

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-8940716-B2 Bicyclic heteroaryl compounds as GPR119 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2015-01-27 US disclosed
US-8940716-B2 Bicyclic heteroaryl compounds as GPR119 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2015-01-27 US disclosed
EP-2566860-B1 BICYCLIC HETEROARYL COMPOUNDS AS GPR119 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2014-09-10 EP disclosed
US-20130053345-A1 BICYCLIC HETEROARLY ANALOGUES AS GPR119 MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2013-02-28 US disclosed
US-20130053345-A1 BICYCLIC HETEROARLY ANALOGUES AS GPR119 MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2013-02-28 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 (1 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-20130053345-A1 BICYCLIC HETEROARLY ANALOGUES AS GPR119 MODULATORS GPR119, GPR139, GPR4 GPR119 1/4885ACACB 4238/4885LIPC 1982/4885

“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.