SCHEMBL6506262

SCHEMBL6506262

NC(=O)Nc1cn(-c2ccc(-c3ccc(C(=O)NCc4ccccc4)cc3)cc2)nc1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.51
ROCK2 O75116 1/20 0.51
RPS6KA5 O75582 1/20 0.51
MAP4K4 O95819 1/20 0.51
PRKCG P05129 1/20 0.51
PRKACA P17612 1/20 0.51
RPS6KB1 P23443 1/20 0.51
AKT1 P31749 1/20 0.51
GSK3A P49840 1/20 0.51
GSK3B P49841 1/20 0.51
PRKX P51817 1/20 0.51
PRKCD Q05655 1/20 0.51
PRKG2 Q13237 1/20 0.51
ROCK1 Q13464 1/20 0.51
DYRK1A Q13627 1/20 0.51
PRKG1 Q13976 1/20 0.51
PKN2 Q16513 1/20 0.51
CDC42BPA Q5VT25 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
SGK2 Q9HBY8 1/20 0.51

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
SCHEMBL6467657 0.86 KMT2A (0.44) MAPK1ROCK2MAP4K4GSK3BCLK4
SCHEMBL6500468 0.84 DGAT1 (0.45) KMT2APARP1MEN1
SCHEMBL6497388 0.84 KDM4E (0.53) MAPK1KMT2APARP1CA1CA2
SCHEMBL6470269 0.83 MAPT (0.44) MAPK1MAP4K4KMT2AMEN1
SCHEMBL6507198 0.83 MAP4K4 (0.47) MAPK1MAP4K4
SCHEMBL6505259 0.82 KDM4E (0.44) MAPK1MAP4K4PARP1
SCHEMBL6468696 0.80 TP53 (0.43) HDAC1HDAC2HDAC3
SCHEMBL6506596 0.80 KDM4E (0.41) MAPK1KMT2APARP1HDAC2MEN1
SCHEMBL6499042 0.80 KDM4E (0.49) MAPK1KMT2APARP1CA1CA2
SCHEMBL6506715 0.79 RAB9A (0.56) KMT2AMEN1

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 MAPK1 1770/4885ROCK2 2042/4885RPS6KA5 708/4885

“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.