SCHEMBL6530102

SCHEMBL6530102

CC(=NNc1ccc(Cl)cc1)C(=O)ON

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.50
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
GAA P10253 5/20 0.50
GFER P55789 3/20 0.50
RECQL P46063 1/20 0.50
KYAT1 Q16773 1/20 0.45
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
SMN1; SMN2 Q16637 6/20 0.43
LMNA P02545 6/20 0.43
ALDH1A1 P00352 5/20 0.43
MAPK1 P28482 3/20 0.43
HTT P42858 3/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
CA4 P22748 1/20 0.42
CA7 P43166 1/20 0.42
ALOX12 P18054 3/20 0.41

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
SCHEMBL6530099 1.00 MAPT (0.50) MAPTMEN1KMT2AGAAGFER
SCHEMBL12266608 0.81 MEN1 (0.64) MAPTMEN1KMT2AGAAGFER
SCHEMBL27841712 0.81 MEN1 (0.64) MAPTMEN1KMT2AGAAGFER
SCHEMBL16379201 0.81 MEN1 (0.56) MAPTMEN1KMT2AGAAGFER
SCHEMBL2172551 0.80 MAPT (0.58) MAPTMEN1KMT2AGAAGFER
SCHEMBL2172548 0.80 MAPT (0.58) MAPTMEN1KMT2AGAAGFER
SCHEMBL6467372 0.77 GAA (0.62) MAPTMEN1KMT2AGAAGFER
SCHEMBL6467370 0.77 GAA (0.62) MAPTMEN1KMT2AGAAGFER
SCHEMBL9633483 0.75 CA1 (0.51) MAPTMEN1KMT2AGAAGFER
SCHEMBL9633488 0.75 CA1 (0.51) MAPTMEN1KMT2AGAAGFER

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 MAPT 1906/4885MEN1 4599/4885KMT2A 3219/4885

“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.