SCHEMBL765911

SCHEMBL765911

FC(F)(F)c1ccc(N2C[C@H]3CC[C@@H](C2)[C@@H]3Oc2cc(C(F)(F)F)n[nH]2)nc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 5/20 0.45
HCRTR2 O43614 5/20 0.45
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
ABL1 P00519 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
CYP3A4 P08684 2/20 0.40
ACACB O00763 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HRH3 Q9Y5N1 2/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD11B1 P28845 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL10212736 0.88 HCRTR1 (0.44) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL13887814 0.88 LCAT (0.36) HCRTR1HCRTR2GPR119
SCHEMBL760110 0.83 KDM4E (0.49) KDM4ELMNAABL1GPR119CYP3A4
SCHEMBL13951427 0.76 HCRTR1 (0.48) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL12932352 0.75 HCRTR1 (0.55) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL12371110 0.73 HCRTR1 (0.42) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL15745702 0.73 HCRTR1 (0.39) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL12371131 0.73 HCRTR1 (0.42) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL10212727 0.72 KDM4E (0.54) HCRTR1HCRTR2KDM4ELMNAABL1
SCHEMBL12371128 0.72 KDM4E (0.54) HCRTR1HCRTR2KDM4ELMNAABL1

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
EP-2050745-B1 N-PYRIDYLPIPERIDINE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PEST CONTROL AGENT OTSUKA AGRITECHNO CO LTD (JP) 2012-03-21 EP disclosed
US-7994094-B2 N-pyridylpiperidine compound, method for producing the same, and pest control agent OTSUKA AGRITECHNO CO., LTD. (JP) 2011-08-09 US disclosed
US-7994094-B2 N-pyridylpiperidine compound, method for producing the same, and pest control agent OTSUKA AGRITECHNO CO., LTD. (JP) 2011-08-09 US disclosed
US-20100137582-A1 N-PYRIDYLPIPERIDINE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PEST CONTROL AGENT OTSUKA CHEMICAL CO., LTD. (JP) 2010-06-03 US disclosed
US-20100137582-A1 N-PYRIDYLPIPERIDINE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PEST CONTROL AGENT OTSUKA CHEMICAL CO., LTD. (JP) 2010-06-03 US 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-20100137582-A1 N-PYRIDYLPIPERIDINE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PEST CONTROL AGENT HRH4, NOX4, PRDX4 HCRTR1 329/4885HCRTR2 860/4885KDM4E 471/4885

“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.