SCHEMBL6434716

SCHEMBL6434716

O=C(Nc1cccc(C(F)(F)F)c1)Nc1cccc(F)c1F

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.67
KMT2A Q03164 3/20 0.67
MEN1 O00255 2/20 0.67
MAPT P10636 2/20 0.67
HTT P42858 1/20 0.67
RAB9A P51151 1/20 0.67
GRIK1 P39086 7/20 0.66
ALDH1A1 P00352 1/20 0.61
TRPV1 Q8NER1 2/20 0.60
NTRK1 P04629 1/20 0.60
CDK19 Q9BWU1 1/20 0.60
IDH1 O75874 1/20 0.57
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
TP53 P04637 1/20 0.56
GAA P10253 1/20 0.56
IDH2 P48735 1/20 0.55

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
SCHEMBL17664319 0.87 KMT2A (0.82) KDRKMT2AMEN1MAPTHTT
SCHEMBL17664213 0.85 KDR (0.67) KDRKMT2AMEN1MAPTHTT
SCHEMBL30101230 0.85 KMT2A (0.90) KDRKMT2AMEN1MAPTHTT
SCHEMBL5597699 0.85 KMT2A (0.90) KDRKMT2AMEN1MAPTHTT
SCHEMBL4548162 0.83 KMT2A (0.87) KDRKMT2AMEN1MAPTHTT
SCHEMBL6434825 0.83 ALDH1A1 (0.64) KMT2AMEN1MAPTHTTALDH1A1
SCHEMBL17664471 0.82 KDR (0.62) KDRKMT2AMEN1MAPTHTT
SCHEMBL24732382 0.82 KDR (0.73) KDRKMT2AMEN1MAPTHTT
SCHEMBL1463167 0.82 KDR (0.73) KDRKMT2AMEN1MAPTHTT
SCHEMBL29591310 0.81 MAPT (0.72) KDRKMT2AMEN1MAPTHTT

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-20050080112-A1 Compounds for use in disorders associated with mast cell or basophil acitvity POSEIDON PHARMACEUTICALS A/S (DK) 2005-04-14 US claimed
US-20050080112-A1 Compounds for use in disorders associated with mast cell or basophil acitvity POSEIDON PHARMACEUTICALS A/S (DK) 2005-04-14 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-20050080112-A1 Compounds for use in disorders associated with mast cell or basophil acitvity CPA3, HNMT, CMA1 KDR 4778/4885KMT2A 1345/4885MEN1 903/4885

“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.