SCHEMBL2334367

SCHEMBL2334367

O=c1nc(-c2cc(C(F)(F)F)c(Cl)cn2)[nH]o1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.34
CYP1A2 P05177 1/20 0.34
PDE3B Q13370 2/20 0.32
PDE3A Q14432 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
COMT P21964 1/20 0.31
KDR P35968 3/20 0.31
CNR2 P34972 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
PTGES O14684 1/20 0.30
BRAF P15056 2/20 0.30

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
SCHEMBL2334938 0.84 KMO (0.31) PDE3BPDE3A
SCHEMBL2334370 0.75 KMO (0.49) NOTUMCYP1A2PDE3BPDE3AMEN1
SCHEMBL2339819 0.71 NOTUM (0.33) NOTUMALDH1A1
SCHEMBL2338600 0.71 NOS3 (0.40) CNR2
SCHEMBL603109 0.71 KMO (0.51) NOTUMCYP1A2ALDH1A1
SCHEMBL601160 0.69 ELANE (0.30)
SCHEMBL1935549 0.68 ALOX5AP (0.40) PDE3BPDE3A
SCHEMBL1935744 0.68 TRPA1 (0.43) PDE3BPDE3APTGES
SCHEMBL2218335 0.68 TRPA1 (0.43) PDE3BPDE3A
SCHEMBL1934823 0.68 JAK2 (0.39) NOTUMPTGES

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-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

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 NOTUM 1449/4885CYP1A2 236/4885PDE3B 432/4885

“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.