SCHEMBL270246

SCHEMBL270246

COc1ccc(CNC(=O)c2cccnc2C[C@H](O)[C@H](N)Cc2ccccc2F)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.51
LMNA P02545 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 2/20 0.51
MAPT P10636 2/20 0.51
KMT2A Q03164 2/20 0.51
EGLN1 Q9GZT9 1/20 0.47
ALDH1A1 P00352 3/20 0.46
GAA P10253 1/20 0.46
MAPK8 P45983 1/20 0.45
POLB P06746 2/20 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
SCHEMBL268900 0.91 KMT2A (0.53) HPGDLMNAMEN1MAPTKMT2A
SCHEMBL3987433 0.90 LMNA (0.47) HPGDLMNASMN1; SMN2MEN1MAPT
SCHEMBL268363 0.90 LMNA (0.47) HPGDLMNASMN1; SMN2MEN1MAPT
SCHEMBL267747 0.88 HPGD (0.54) HPGDLMNASMN1; SMN2KMT2AALDH1A1
Hydrochloric Acid SCHEMBL269080 0.87 HPGD (0.53) HPGDLMNASMN1; SMN2KMT2AALDH1A1
SCHEMBL268272 0.84 LMNA (0.48) HPGDLMNAMEN1MAPTKMT2A
SCHEMBL268989 0.84 LMNA (0.45) LMNASMN1; SMN2MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL270565 0.83 LMNA (0.47) HPGDLMNAMEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL270684 0.83 LMNA (0.44) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL269582 0.82 LMNA (0.43) LMNASMN1; SMN2MEN1KMT2AMAPK8

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-8133907-B2 Type II diabetes, obesity, hyperglycemia and a lipid disorder selected from dyslipidemia, hyperlipidemia, hypertriglyceridemia, hypercholesterolemia, low HDL and high LDL; additionally comprising metformin ELI LILLY AND COMPANY (US) 2012-03-13 US disclosed
EP-1912946-B1 PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS LILLY CO ELI (US) 2009-05-27 EP disclosed
US-20080214616-A1 Pyridine Derivatives as Dipeptedyl Peptidase Inhibitors ELI LILLY AND COMPANY 2008-09-04 US disclosed
EP-1912946-A1 PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS Eli Lilly and Company (US) 2008-04-23 EP disclosed
WO-2007015767-A1 PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS ELI LILLY AND COMPANY (US) 2007-02-08 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-20080214616-A1 Pyridine Derivatives as Dipeptedyl Peptidase Inhibitors DPP4, DPP3, DPP7 HPGD 1844/4885LMNA 4670/4885SMN1; SMN2 4330/4885

“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.