SCHEMBL2170397

SCHEMBL2170397

CCON=C(c1ncc(C(F)(F)F)cc1C)n1cncn1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.40
HPGD P15428 2/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 2/20 0.35
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
ALDH1A1 P00352 6/20 0.34
AGBL2 Q5U5Z8 1/20 0.34
POLB P06746 3/20 0.34
GAA P10253 2/20 0.34
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL2359520 0.90 ALDH1A1 (0.42) NPSR1HPGDMEN1KMT2AL3MBTL1
SCHEMBL2258580 0.87 NPSR1 (0.37) NPSR1HPGDMEN1KMT2AL3MBTL1
SCHEMBL2168671 0.83 NPSR1 (0.39) NPSR1HPGDMEN1KMT2AKDM4E
SCHEMBL2252796 0.83 NPSR1 (0.39) NPSR1HPGDMEN1KMT2AKDM4E
SCHEMBL15918560 0.78 ALDH1A1 (0.36) KMT2AL3MBTL1KDM4EALDH1A1POLB
SCHEMBL2256065 0.76 ALDH1A1 (0.41) NPSR1HPGDMEN1KMT2AKDM4E
SCHEMBL2254716 0.73 NPSR1 (0.50) NPSR1HPGDMEN1KMT2AKDM4E
SCHEMBL2170796 0.73 NPSR1 (0.50) NPSR1HPGDMEN1KMT2AKDM4E
SCHEMBL2169625 0.68 ALDH1A1 (0.50) NPSR1HPGDMEN1KMT2AKDM4E
SCHEMBL2170802 0.67 ALDH1A1 (0.52) NPSR1HPGDMEN1KMT2AL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195930-A1 PYRIDINE DERIVATIVE OR ITS SALT, PESTICIDE CONTAINING IT AND PROCESS FOR ITS PRODUCTION ISHIHARA SANGYO KAISHA, LTD. (JP) 2011-08-11 US disclosed
EP-2346851-A2 PYRIDINE DERIVATIVE OR ITS SALT, PESTICIDE CONTAINING IT AND PROCESS FOR ITS PRODUCTION ISHIHARA SANGYO KAISHA, LTD. (JP) 2011-07-27 EP disclosed
WO-2010055896-A2 PYRIDINE DERIVATIVE OR ITS SALT, PESTICIDE CONTAINING IT AND PROCESS FOR ITS PRODUCTION ISHIHARA SANGYO KAISHA, LTD. (JP) 2010-05-20 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-20110195930-A1 PYRIDINE DERIVATIVE OR ITS SALT, PESTICIDE CONTAINING IT AND PROCESS FOR ITS PRODUCTION NOX3, SCN3A, OR10J3 NPSR1 1687/4885HPGD 2687/4885MEN1 3611/4885

“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.