SCHEMBL6502148

SCHEMBL6502148

CNC(=O)COc1ccc(F)cc1-c1ccc(-n2cc(NC(N)=O)c(C(N)=O)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.40
LMNA P02545 4/20 0.40
MAPT P10636 3/20 0.40
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 5/20 0.39
HPGD P15428 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.37
ITK Q08881 1/20 0.37
NPC1 O15118 1/20 0.36
SCN9A Q15858 2/20 0.35
SCN10A Q9Y5Y9 1/20 0.35
GRM2 Q14416 1/20 0.35
LRRK2 Q5S007 1/20 0.35
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35

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
SCHEMBL6465688 0.91 RAB9A (0.39) RAB9ALMNAMAPTHTTNPSR1
SCHEMBL6504773 0.91 KDM4E (0.38) RAB9ALMNAMAPTHTTNPSR1
SCHEMBL6478556 0.90 PTGDR2 (0.45) LMNAMAPTHTTSMN1; SMN2ALDH1A1
SCHEMBL6499913 0.86 LRRK2 (0.46) RAB9AMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL6470117 0.85 ALOX5AP (0.39) RAB9ALMNAMAPTHTTALDH1A1
SCHEMBL6470068 0.84 FKBP1A (0.45) MAPTHTTSMN1; SMN2HPGDALDH1A1
SCHEMBL6505508 0.81 IRAK4 (0.37) RAB9ALMNAMAPTHTTALDH1A1
SCHEMBL6468656 0.81 ITK (0.43) RAB9ALMNAMAPTHTTSMN1; SMN2
SCHEMBL6467401 0.80 KDM4E (0.41) RAB9ALMNAMAPTHTTSMN1; SMN2
SCHEMBL6508966 0.80 ITK (0.45) RAB9ALMNAMAPTHTTNPSR1

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 RAB9A 2534/4885LMNA 1826/4885MAPT 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.