SCHEMBL3102175

SCHEMBL3102175

COCc1oc(-c2ccccc2)cc1C(CC(C)C)Nc1ccc(C(=O)N(C)CCC(=O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCG P01275 3/20 0.39
NAMPT P43490 4/20 0.35
DGAT1 O75907 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HDAC6 Q9UBN7 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 1/20 0.34
PPARD Q03181 4/20 0.34
ATR Q13535 1/20 0.33
MCHR1 Q99705 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL3093925 0.91 GCG (0.42) GCGNAMPTALDH1A1HDAC6MEN1
SCHEMBL3109262 0.87 GCG (0.41) GCGNAMPTDGAT1ALDH1A1HDAC6
SCHEMBL3099962 0.86 NAMPT (0.35) GCGNAMPTHDAC6
SCHEMBL3094037 0.85 GCG (0.48) GCGALDH1A1MEN1KMT2APKM
SCHEMBL3113203 0.85 ALDH1A1 (0.37) GCGALDH1A1MEN1KMT2APKM
SCHEMBL3099245 0.83 GCG (0.39) GCGNAMPTALDH1A1HDAC6MEN1
SCHEMBL3104644 0.81 ALDH1A1 (0.43) GCGALDH1A1MEN1KMT2APKM
SCHEMBL3111733 0.81 HSD17B2 (0.40) GCGALDH1A1HDAC6KMT2AMAPT
SCHEMBL3102884 0.81 MEN1 (0.38) GCGNAMPTDGAT1ALDH1A1HDAC6
SCHEMBL3101498 0.79 NAMPT (0.38) GCGNAMPTALDH1A1HDAC6MEN1

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 GCG 11/4885NAMPT 2658/4885DGAT1 3411/4885

“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.