SCHEMBL2946729

SCHEMBL2946729

FC(F)(F)CNc1noc2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.64
EPHX2 P34913 11/20 0.61
TP53 P04637 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ACHE P22303 2/20 0.45
CHRNA7 P36544 2/20 0.40
HTR3A P46098 2/20 0.40

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
SCHEMBL2769744 0.76 EPHX2 (1.00) KCNA5EPHX2
SCHEMBL11443225 0.75 KCNA5 (0.57) KCNA5EPHX2TP53SMN1; SMN2ACHE
SCHEMBL2768006 0.74 EPHX2 (0.72) KCNA5EPHX2SMN1; SMN2ACHE
SCHEMBL16259070 0.73 KCNA5 (0.56) KCNA5EPHX2TP53SMN1; SMN2ACHE
SCHEMBL1760399 0.73 KCNA5 (0.52) KCNA5EPHX2TP53SMN1; SMN2ACHE
SCHEMBL2769324 0.73 EPHX2 (0.70) KCNA5EPHX2TP53SMN1; SMN2ACHE
SCHEMBL9828963 0.72 KCNA5 (0.55) KCNA5EPHX2TP53SMN1; SMN2ACHE
SCHEMBL2767837 0.71 EPHX2 (0.67) KCNA5EPHX2TP53SMN1; SMN2HTR3A
SCHEMBL3516609 0.71 EPHX2 (0.51) KCNA5EPHX2TP53SMN1; SMN2ACHE
SCHEMBL2768711 0.71 KCNA5 (0.54) KCNA5EPHX2TP53SMN1; SMN2ACHE

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-7759337-B2 Phthalazine compounds and methods of use AMGEN INC. (US) 2010-07-20 US disclosed
US-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2006-09-07 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-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use DAPK2, CDK2, DAPK1 KCNA5 1298/4885EPHX2 2212/4885TP53 663/4885

“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.