SCHEMBL6508324

SCHEMBL6508324

COC(=O)c1ccc(-c2ccc(-n3cc(NC(N)=O)c(C(N)=O)n3)cc2)c(N)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 2/20 0.45
KDM4E B2RXH2 7/20 0.43
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
MAPT P10636 4/20 0.43
NPC1 O15118 3/20 0.43
HSD17B10 Q99714 3/20 0.43
RAB9A P51151 2/20 0.43
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
ITK Q08881 1/20 0.41
HPGD P15428 4/20 0.38
HTT P42858 2/20 0.38
GAA P10253 2/20 0.38
GLA P06280 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 2/20 0.38

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
SCHEMBL6500092 0.86 KDM4E (0.47) MAPKAPK2KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL6472892 0.80 TP53 (0.54) KDM4EALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL6507198 0.79 MAP4K4 (0.47) MAPKAPK2KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL6506528 0.78 KMT2A (0.46) MAPKAPK2KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL6500307 0.77 MAPT (0.49) KDM4EALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL6470269 0.77 MAPT (0.44) KDM4EALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL6505259 0.76 KDM4E (0.44) MAPKAPK2KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL6500174 0.76 ITK (0.41) MAPKAPK2KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL6468173 0.76 PDE4D (0.44) MAPKAPK2KDM4EALDH1A1MAPTNPC1
SCHEMBL6499913 0.76 LRRK2 (0.46) MAPKAPK2KDM4EALDH1A1SMN1; SMN2MAPT

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
WO-2005082897-A1 OXAZOLIDINONE ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-09-09 WO disclosed
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 MAPKAPK2 1802/4885KDM4E 2424/4885ALDH1A1 846/4885

“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.