SCHEMBL764503

SCHEMBL764503

C[C@H]1CN(c2ccc(C(F)(F)F)cn2)CC[C@@H]1Oc1cc(-c2cc(F)cc(F)c2)n[nH]1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HRH3 Q9Y5N1 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ABL1 P00519 1/20 0.39
LMNA P02545 1/20 0.39
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
SLC6A9 P48067 4/20 0.38
LCAT P04180 4/20 0.37
GPR119 Q8TDV5 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL764504 1.00 SCD (0.40) SCDL3MBTL1HRH3KDM4EABL1
SCHEMBL764505 1.00 SCD (0.40) SCDL3MBTL1HRH3KDM4EABL1
SCHEMBL15745706 0.77 SCD (0.39) SCDL3MBTL1HRH3KDM4EABL1
SCHEMBL10212980 0.77 NAAA (0.35) L3MBTL1KDM4EABL1LMNADPP4
SCHEMBL761354 0.77 NAAA (0.35) L3MBTL1KDM4EABL1LMNADPP4
SCHEMBL760740 0.77 CHRM2 (0.37) SCDL3MBTL1HRH3KDM4EABL1
SCHEMBL760741 0.77 CHRM2 (0.37) SCDL3MBTL1HRH3KDM4EABL1
SCHEMBL760739 0.77 CHRM2 (0.37) SCDL3MBTL1HRH3KDM4EABL1
SCHEMBL15745705 0.77 HRH3 (0.37) SCDL3MBTL1HRH3KDM4EABL1
SCHEMBL765908 0.77 CXCR3 (0.36) L3MBTL1HRH3TDP1LCATKMT2A

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 4 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-20100137582-A1 N-PYRIDYLPIPERIDINE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PEST CONTROL AGENT OTSUKA CHEMICAL CO., LTD. (JP) 2010-06-03 US disclosed
EP-2050745-A1 N-PYRIDYLPIPERIDINE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PEST CONTROL AGENT Otsuka Chemical Co., Ltd. (JP) 2009-04-22 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-20100137582-A1 N-PYRIDYLPIPERIDINE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PEST CONTROL AGENT HRH4, NOX4, PRDX4 SCD 4570/4885L3MBTL1 306/4885HRH3 6/4885

“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.