SCHEMBL6470635

SCHEMBL6470635

N#C/C(=N\Nc1ccc(I)c(Cl)c1)C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.54
HTT P42858 6/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
ALOX12 P18054 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
GAA P10253 4/20 0.48
GFER P55789 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
MAPK1 P28482 1/20 0.48
RAPGEF3 O95398 7/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44

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
SCHEMBL6470640 1.00 MAPT (0.54) MAPTHTTNPC1RAB9AALOX12
SCHEMBL6467676 0.84 MAPT (0.58) MAPTHTTNPC1RAB9AALOX12
SCHEMBL6467671 0.84 MAPT (0.58) MAPTHTTNPC1RAB9AALOX12
SCHEMBL6467571 0.76 MAPT (0.48) MAPTHTTNPC1RAB9AALOX12
SCHEMBL6467565 0.76 MAPT (0.48) MAPTHTTNPC1RAB9AALOX12
SCHEMBL6469662 0.73 MAPT (0.54) MAPTHTTNPC1RAB9AALOX12
SCHEMBL20843975 0.73 MAPT (0.58) MAPTHTTNPC1RAB9AALOX12
SCHEMBL6469661 0.73 MAPT (0.54) MAPTHTTNPC1RAB9AALOX12
SCHEMBL9422023 0.70 MAPT (0.62) MAPTHTTNPC1RAB9AALOX12
SCHEMBL9422030 0.70 MAPT (0.62) MAPTHTTNPC1RAB9AALOX12

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 MAPT 1906/4885HTT 4097/4885NPC1 3546/4885

“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.