SCHEMBL14728958

SCHEMBL14728958

CC(C)(O)CCS(=O)(=O)N1CCC(c2ccc3nc(OC4CCN(C(=O)Oc5ccc(F)cc5)CC4)sc3c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.38
LMNA P02545 3/20 0.35
ACACB O00763 3/20 0.34
GPR119 Q8TDV5 2/20 0.34
PDE4B Q07343 1/20 0.34
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ESR1 P03372 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TRPC6 Q9Y210 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 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
SCHEMBL14729154 0.93 TLR9 (0.38) FAAHLMNAACACBGPR119PDE4B
SCHEMBL14728960 0.88 FAAH (0.38) FAAHLMNAPDE4BMAPTTP53
SCHEMBL14729019 0.85 ACACB (0.36) ACACBGPR119PDE4BMAPTKDM4E
SCHEMBL14728962 0.84 PDE4B (0.44) GPR119PDE4BSMN1; SMN2
SCHEMBL14728957 0.84 GPR119 (0.40) LMNAACACBGPR119MAPTTP53
SCHEMBL14729153 0.82 TLR9 (0.39) FAAHLMNAACACBGPR119PDE4B
SCHEMBL14729183 0.81 GPR119 (0.40) ACACBGPR119MAPT
SCHEMBL14729021 0.81 GPR119 (0.36) ACACBGPR119PDE4BKDM4EALDH1A1
SCHEMBL14729056 0.79 GPR119 (0.40) ACACBGPR119MAPT
SCHEMBL14728944 0.78 GPR119 (0.50) ACACBGPR119KDM4E

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 4 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
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 FAAH 1378/4885LMNA 2531/4885ACACB 4238/4885

“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.