SCHEMBL6506967

SCHEMBL6506967

COc1ccc(Cl)cc1-c1cccc(-n2cc(NC(N)=O)c(C(N)=O)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.51
SCN9A Q15858 1/20 0.46
MAPT P10636 2/20 0.43
POLB P06746 2/20 0.43
KMT2A Q03164 7/20 0.43
MEN1 O00255 6/20 0.43
ITK Q08881 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PTGES2 Q9H7Z7 1/20 0.42
KDM4E B2RXH2 1/20 0.41
SLC9A1 P19634 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
MAPK14 Q16539 1/20 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
SCHEMBL6468173 0.89 PDE4D (0.44) PDE4DMAPTPOLBKMT2AMEN1
SCHEMBL6507806 0.89 SCN9A (0.57) SCN9AMAPTPOLBKMT2AMEN1
SCHEMBL6499825 0.86 KMT2A (0.51) SCN9AMAPTPOLBKMT2AMEN1
SCHEMBL6506563 0.85 SCN9A (0.46) SCN9AMAPTPOLBKMT2AMEN1
SCHEMBL6499924 0.84 IKBKB (0.48) SCN9AMAPTPOLBKMT2AMEN1
SCHEMBL6498355 0.83 KDM4E (0.47) SCN9AMAPTKMT2AMEN1ITK
SCHEMBL6497796 0.83 SCN9A (0.46) SCN9AMAPTPOLBKMT2AMEN1
SCHEMBL6497552 0.81 IRAK4 (0.54) SCN9AMAPTKMT2AMEN1ITK
SCHEMBL6468677 0.81 MEN1 (0.47) MAPTPOLBKMT2AMEN1ITK
SCHEMBL6508463 0.81 ITK (0.45) SCN9AMAPTPOLBKMT2AMEN1

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 PDE4D 1581/4885SCN9A 4159/4885MAPT 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.