SCHEMBL6497904

SCHEMBL6497904

N#C/C(=N\Nc1cc(Cl)ccc1F)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
MAPT P10636 7/20 0.46
GAA P10253 2/20 0.46
GFER P55789 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAPK1 P28482 1/20 0.46
ALOX12 P18054 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.42
HTT P42858 3/20 0.42
LMNA P02545 3/20 0.42
HPGD P15428 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
NPY1R P25929 1/20 0.42

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
SCHEMBL6497905 1.00 MEN1 (0.48) MEN1KMT2AMAPTGAAGFER
SCHEMBL6508195 0.77 MAPT (0.53) MEN1KMT2AMAPTGAAGFER
SCHEMBL6508197 0.77 MAPT (0.53) MEN1KMT2AMAPTGAAGFER
SCHEMBL6466358 0.77 MAPT (0.45) MEN1KMT2AMAPTALOX12CYP1A2
SCHEMBL6466354 0.77 MAPT (0.45) MEN1KMT2AMAPTALOX12CYP1A2
SCHEMBL15286118 0.74 MAPT (0.45) MEN1KMT2AMAPTGAAGFER
SCHEMBL6467571 0.74 MAPT (0.48) MEN1KMT2AMAPTGAAGFER
SCHEMBL6467565 0.74 MAPT (0.48) MEN1KMT2AMAPTGAAGFER
SCHEMBL15285773 0.74 MAPT (0.45) MEN1KMT2AMAPTGAAGFER
SCHEMBL6469662 0.71 MAPT (0.54) MEN1KMT2AMAPTGAAGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation PHARMACIA AND UPJOHN COMPANY LLC 2005-09-08 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-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation IL4, ARG2, CASP4 MEN1 4599/4885KMT2A 3219/4885MAPT 1906/4885

“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.