SCHEMBL269195

SCHEMBL269195

O=CC(Cc1ccccc1F)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 3/20 0.46
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
TAS2R14 Q9NYV8 2/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
LPAR1 Q92633 1/20 0.36
LPAR5 Q9H1C0 1/20 0.36
KCNA5 P22460 1/20 0.36
ACKR3 P25106 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
NR3C1 P04150 1/20 0.35

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
SCHEMBL269194 1.00 ALDH1A1 (0.46) ALDH1A1KDM4ETDP1SMN1; SMN2KMT2A
SCHEMBL268576 0.86 DPP4 (0.45) ALDH1A1KDM4ETDP1KCNA5
SCHEMBL268577 0.86 DPP4 (0.45) ALDH1A1KDM4ETDP1KCNA5
SCHEMBL475432 0.82 EPHX1 (0.44) ALDH1A1KMT2AMEN1GAAHTT
SCHEMBL475431 0.82 EPHX1 (0.44) ALDH1A1KMT2AMEN1GAAHTT
SCHEMBL14130060 0.79 TDP1 (0.36) TDP1KMT2AMEN1TAS2R14KCNA5
SCHEMBL475774 0.79 TDP1 (0.36) TDP1KMT2AMEN1TAS2R14KCNA5
SCHEMBL475776 0.79 TDP1 (0.36) TDP1KMT2AMEN1TAS2R14KCNA5
SCHEMBL475507 0.78 SLC1A1 (0.43) TDP1KMT2AMEN1TAS2R14PPARG
SCHEMBL475506 0.78 SLC1A1 (0.43) TDP1KMT2AMEN1TAS2R14PPARG

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 ALDH1A1 557/4885KDM4E 2417/4885TDP1 3526/4885

“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.