SCHEMBL3095083

SCHEMBL3095083

Cc1oc(-c2ccc(OCCCS(C)(=O)=O)cc2)cc1C(Nc1ccc(C(=O)N(C)CCC(=O)O)cc1)C1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.34
FFAR4 Q5NUL3 2/20 0.34
SLC6A9 P48067 1/20 0.33
RCE1 Q9Y256 1/20 0.33
MCHR1 Q99705 1/20 0.32
HRH3 Q9Y5N1 2/20 0.32
S1PR1 P21453 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
DGAT1 O75907 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 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
SCHEMBL3110132 0.93 ESR1 (0.34) SLC6A9S1PR1ALDH1A1MAPTMEN1
SCHEMBL3110126 0.90 SLC6A9 (0.33) SLC6A9RCE1MCHR1S1PR1DGAT1
SCHEMBL13094285 0.89 SLC6A9 (0.34) SLC6A9RCE1MCHR1DGAT1ALDH1A1
SCHEMBL3102238 0.88 GCG (0.41) S1PR1
SCHEMBL3098449 0.87 KMT2A (0.35) RCE1S1PR1ALDH1A1MAPTMEN1
SCHEMBL13093864 0.85 ALDH1A1 (0.41) SLC6A9RCE1MCHR1DGAT1ALDH1A1
SCHEMBL3101780 0.85 GCGR (0.45) MCHR1ALDH1A1MEN1KMT2A
SCHEMBL3106912 0.84 MMP13 (0.37) SLC6A9RCE1MCHR1ALDH1A1MAPT
SCHEMBL3102500 0.84 TACR1 (0.39) RCE1MCHR1ALDH1A1MAPTMEN1
SCHEMBL3102136 0.84 ALDH1A1 (0.41) RCE1MCHR1DGAT1ALDH1A1MAPT

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2210876-B1 HETEROCYCLIC COMPOUND AS GLUCAGON ANTAGONIST TAKEDA PHARMACEUTICAL (JP) 2015-05-20 EP disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
EP-2210876-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-07-28 EP 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-20100256156-A1 HETEROCYCLIC COMPOUND GLP1R, GPR119, GCGR FFAR1 509/4885FFAR4 779/4885SLC6A9 1729/4885

“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.