SCHEMBL2332695

SCHEMBL2332695

CC(C)N(C(=O)n1c(-c2cc(C(F)(F)F)ccn2)noc1=O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.40
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
MDM2 Q00987 1/20 0.35
ABL1 P00519 1/20 0.34
BCR P11274 1/20 0.34
KCNT1 Q5JUK3 1/20 0.34
PLAT P00750 1/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
EPAS1 Q99814 1/20 0.33
P2RX7 Q99572 1/20 0.33
SYK P43405 3/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C8 P10632 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL2333905 0.89 NPSR1 (0.39) NPSR1HCRTR1HCRTR2MDM2ABL1
SCHEMBL13028265 0.86 NPSR1 (0.38) NPSR1HCRTR1HCRTR2MDM2ABL1
SCHEMBL2335387 0.86 ALDH1A1 (0.38) NPSR1HCRTR1HCRTR2MDM2ABL1
SCHEMBL2342360 0.85 NPSR1 (0.36) NPSR1HCRTR1HCRTR2ABL1BCR
SCHEMBL2335764 0.83 NPSR1 (0.37) NPSR1HCRTR1HCRTR2ABL1BCR
SCHEMBL2340935 0.82 FAAH (0.34) NPSR1HCRTR1HCRTR2MDM2ABL1
SCHEMBL2340988 0.81 SYK (0.40) HCRTR1HCRTR2PLATP2RX7SYK
SCHEMBL2335213 0.80 ALDH1A1 (0.36) NPSR1HCRTR1HCRTR2ABL1BCR
SCHEMBL2339420 0.79 ALDH1A1 (0.38) NPSR1HCRTR1HCRTR2ABL1BCR
SCHEMBL2334760 0.78 NPSR1 (0.42) NPSR1HCRTR1HCRTR2ABL1BCR

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-8318776-B2 Pyridine compound, pesticidal composition and method of controlling pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-27 US disclosed
EP-2215086-B1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST SUMITOMO CHEMICAL CO (JP) 2011-08-24 EP disclosed
US-20100286148-A1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-11 US disclosed
EP-2215086-A1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST Sumitomo Chemical Company, Limited (JP) 2010-08-11 EP disclosed
WO-2009066786-A1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-28 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-20100286148-A1 PYRIDINE COMPOUND, PESTICIDAL COMPOSITION AND METHOD OF CONTROLLING PEST C5, PRDX1, PLPBP NPSR1 1849/4885HCRTR1 787/4885HCRTR2 1717/4885

“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.