SCHEMBL14729074

SCHEMBL14729074

O=S(=O)(CCCO)N1CC=C(c2ccc3nc(OC4CCN(c5ccc(Cl)cn5)CC4)sc3c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.43
DGAT1 O75907 2/20 0.35
ADORA2A P29274 2/20 0.35
KCNH2 Q12809 2/20 0.35
ENPP2 Q13822 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34

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
SCHEMBL14729073 0.98 GPR119 (0.43) GPR119DGAT1ADORA2AKCNH2MMP2
SCHEMBL14729192 0.92 GPR119 (0.44) GPR119ENPP2
SCHEMBL14728931 0.91 GPR119 (0.49) GPR119ENPP2MMP2MMP3
SCHEMBL14729076 0.91 GPR119 (0.41) GPR119DGAT1ADORA2AKCNH2
SCHEMBL14729189 0.90 GPR119 (0.45) GPR119
SCHEMBL14729075 0.90 GPR119 (0.42) GPR119DGAT1ADORA2AKCNH2
SCHEMBL14728969 0.89 GPR119 (0.50) GPR119MMP2MMP3
SCHEMBL12177992 0.89 GPR119 (0.44) GPR119ENPP2MMP2MMP3
SCHEMBL14729069 0.88 GPR119 (0.52) GPR119DGAT1ADORA2AKCNH2
SCHEMBL14729085 0.87 GPR119 (0.45) GPR119ENPP2MMP2MMP3

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 1/4885DGAT1 707/4885ADORA2A 147/4885

“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.