SCHEMBL14728955

SCHEMBL14728955

CCCc1cnc(N2CCC(Cc3nc4ccc(C5CCN(S(=O)(=O)CCC(C)(C)O)CC5)cc4o3)CC2)nc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 17/20 0.51
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL14728956 0.96 GPR119 (0.50) GPR119KDM4ENPC1RAB9A
SCHEMBL14728951 0.92 GPR119 (0.60) GPR119KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14728953 0.90 GPR119 (0.52) GPR119KDM4ENPC1RAB9A
SCHEMBL14728954 0.89 GPR119 (0.52) GPR119KDM4ENPC1RAB9A
SCHEMBL14728945 0.84 GPR119 (0.55) GPR119
SCHEMBL2588548 0.81 GPR119 (0.49) GPR119KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14728948 0.81 GPR119 (0.59) GPR119KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14728944 0.79 GPR119 (0.50) GPR119KDM4ENPC1RAB9A
SCHEMBL14728949 0.79 GPR119 (0.52) GPR119KDM4ENPC1RAB9A
SCHEMBL14728950 0.78 GPR119 (0.51) GPR119KDM4ENPC1RAB9A

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 1/4885KDM4E 1820/4885NPC1 967/4885

“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.