SCHEMBL6470262

SCHEMBL6470262

NC(=O)c1nn(-c2ccc(Br)c(F)c2)c(C(=O)O)c1N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
CHEK1 O14757 1/20 0.34
AURKA O14965 1/20 0.34
CSNK1A1 P48729 1/20 0.34
CDK8 P49336 1/20 0.34
NEK2 P51955 1/20 0.34
LIMK1 P53667 1/20 0.34
CDK5 Q00535 1/20 0.34
DYRK1A Q13627 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
KIF11 P52732 1/20 0.34
F10 P00742 1/20 0.34
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL6469689 0.83 ALDH1A1 (0.56) KMT2ACA1CA2KDM4EALDH1A1
SCHEMBL6470677 0.79 HSD17B10 (0.43) KMT2ACA1CA2KDM4EALDH1A1
SCHEMBL6470354 0.75 CA1 (0.48) KMT2ACA1CA2KDM4EALDH1A1
SCHEMBL6470586 0.75 RPA1 (0.39) KMT2ACA1CA2KDM4EALDH1A1
SCHEMBL6469734 0.73 ALDH1A1 (0.43) KMT2AKDM4EALDH1A1GAAMEN1
SCHEMBL6470190 0.73 PARP1 (0.38) KMT2ACA1CA2KDM4EALDH1A1
SCHEMBL6506589 0.72 MAP2K1 (0.36) KMT2AALDH1A1DYRK1A
SCHEMBL6470216 0.69 ALDH1A1 (0.53) KMT2ACA1CA2KDM4EALDH1A1
Potassium SCHEMBL6498895 0.68 RIPK1 (0.45) KMT2AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6498887 0.68 RIPK1 (0.45) KMT2AKDM4EALDH1A1HPGDHSD17B10

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-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation PHARMACIA AND UPJOHN COMPANY LLC 2005-09-08 US disclosed
WO-2005037797-A1 SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2005-04-28 WO 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 KMT2A 3219/4885CA1 3159/4885CA2 3703/4885

“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.