SCHEMBL7034725

SCHEMBL7034725

[O]c1c[nH]c(C(F)(F)F)n1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDM5A P29375 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
HCAR2 Q8TDS4 1/20 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
SCHEMBL2161282 0.73 NPSR1 (0.33) NPSR1
SCHEMBL6246411 0.71 CSNK2A1 (0.36) NPSR1
SCHEMBL7034733 0.71 NPSR1 (0.32) NPSR1
SCHEMBL14446900 0.71 MAPT (0.36) NPSR1
SCHEMBL21617985 0.70 KDM4E (0.39) PKMHCAR2
SCHEMBL24175338 0.68 KDM4E (0.31) NPSR1
SCHEMBL21209217 0.67 CYP3A4 (0.38)
SCHEMBL4321299 0.66 MAPT (0.33) NPSR1
SCHEMBL7992596 0.64
SCHEMBL22541579 0.59 HSP90AA1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212116-A1 Heterocyclic imino compounds and fungicides and insecticides for agricultural and horitcultural use NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-11-13 US disclosed
EP-1243580-A1 HETEROCYCLIC IMINO COMPOUNDS AND FUNGICIDES AND INSECTICIDES FOR AGRICULTURAL AND HORTICULTURAL USE Nissan Chemical Industries, Ltd. (JP) 2002-09-25 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-20030212116-A1 Heterocyclic imino compounds and fungicides and insecticides for agricultural and horitcultural use DDT, CBR3, CYP1B1 PKM 4307/4885NPSR1 4301/4885KDM5A 1512/4885

“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.