SCHEMBL2270818

SCHEMBL2270818

CCCCCCC(=O)c1ccc(Cl)nc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 7/20 0.57
NAPRT Q6XQN6 1/20 0.50
FAAH O00519 1/20 0.50
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
STS P08842 4/20 0.47
DGAT1 O75907 1/20 0.46
HTR7 P34969 1/20 0.46
S1PR5 Q9H228 1/20 0.45
GRM4 Q14833 1/20 0.45

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
SCHEMBL2271956 0.98 HSD17B3 (0.56) HSD17B3NAPRTFAAHMAPTRAB9A
SCHEMBL20372049 0.94 HSD17B3 (0.54) HSD17B3NAPRTMAPTRAB9AL3MBTL1
SCHEMBL11899972 0.87 NAPRT (0.56) HSD17B3NAPRTMAPTRAB9AL3MBTL1
SCHEMBL2659932 0.86 HSD17B3 (0.43) HSD17B3NAPRTFAAHMAPTRAB9A
SCHEMBL2659933 0.86 HSD17B3 (0.43) HSD17B3NAPRTFAAHMAPTRAB9A
SCHEMBL2659930 0.86 HSD17B3 (0.43) HSD17B3NAPRTFAAHMAPTRAB9A
SCHEMBL3299695 0.85 NAPRT (0.55) NAPRTMAPTRAB9AL3MBTL1DGAT1
SCHEMBL2660622 0.85 HSD17B3 (0.43) HSD17B3NAPRTFAAHMAPTRAB9A
SCHEMBL1985578 0.83 NAPRT (0.64) NAPRTMAPTRAB9AL3MBTL1DGAT1
SCHEMBL24998116 0.81 HSD17B3 (0.57) HSD17B3MAPTSTSHTR7

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-1758859-B1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2013-07-17 EP disclosed
US-7989457-B2 Used to treat diabetic and other glucagon related metabolic disorders such as obesity, hyperglycemia, atherosclerosis, ischemic heart disease, stroke, neuropathy, and wound healing; (R,S)-Methanesulfonic acid 2-(3-methyl-4'-trifluoromethyl-biphenyl-4-yl)-propyl ester ELI LILLY AND COMPANY (US) 2011-08-02 US disclosed
US-7989457-B2 Used to treat diabetic and other glucagon related metabolic disorders such as obesity, hyperglycemia, atherosclerosis, ischemic heart disease, stroke, neuropathy, and wound healing; (R,S)-Methanesulfonic acid 2-(3-methyl-4'-trifluoromethyl-biphenyl-4-yl)-propyl ester ELI LILLY AND COMPANY (US) 2011-08-02 US disclosed
US-20080125468-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses ELI LILLY AND COMPANY 2008-05-29 US disclosed
US-20080125468-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses ELI LILLY AND COMPANY 2008-05-29 US disclosed
EP-1758859-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-03-07 EP disclosed
WO-2005118542-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-15 WO disclosed
WO-2005118542-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-15 WO 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-20080125468-A1 Glucagon Receptor Antagonists, Preparation and Therapeutic Uses GLP1R, GCGR, GIPR HSD17B3 803/4885NAPRT 3786/4885FAAH 1383/4885

“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.