SCHEMBL6430890

SCHEMBL6430890

O=C(NCc1cccc(C(F)(F)F)c1)Nc1ccccc1C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CFD P00746 1/20 0.69
GRIK1 P39086 2/20 0.66
TRPV1 Q8NER1 3/20 0.65
RXFP1 Q9HBX9 3/20 0.57
GAA P10253 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
MAPK14 Q16539 1/20 0.52
MLYCD O95822 1/20 0.51
MTOR P42345 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
EPHX2 P34913 1/20 0.51
TRPM2 O94759 1/20 0.50

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
SCHEMBL6431222 0.82 RXFP1 (0.71) GRIK1RXFP1GAAKDM4EALDH1A1
SCHEMBL23864576 0.82 KMT2A (0.66) RXFP1GAAMEN1KMT2AMAPK14
SCHEMBL24713109 0.81 MLYCD (0.67) TRPV1GAAKDM4EMEN1KMT2A
SCHEMBL30279458 0.81 GRIK1 (0.59) GRIK1RXFP1GAAALDH1A1MEN1
SCHEMBL22497529 0.81 GRIK1 (0.59) GRIK1RXFP1GAAALDH1A1MEN1
SCHEMBL27546747 0.81 HCAR2 (0.60) GRIK1RXFP1GAAMEN1KMT2A
SCHEMBL27521543 0.80 GRIK1 (0.62) GRIK1RXFP1GAAMEN1KMT2A
SCHEMBL1463217 0.80 GRIK1 (1.00) GRIK1TRPV1RXFP1KDM4EMEN1
SCHEMBL22524969 0.80 GRIK1 (0.58) GRIK1RXFP1GAAMEN1KMT2A
SCHEMBL23447441 0.78 MAPT (0.71) GRIK1RXFP1GAAKDM4EALDH1A1

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 CFD 2266/4885GRIK1 655/4885TRPV1 206/4885

“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.