SCHEMBL13993552

SCHEMBL13993552

Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(C)CC1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 15/20 0.61
PROKR1 Q8TCW9 15/20 0.61
TP53 P04637 1/20 0.56
LMNA P02545 1/20 0.56
ALDH1A1 P00352 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56

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
SCHEMBL15548422 0.79 ALDH1A1 (0.57) FPR2PROKR1ALDH1A1NPSR1
SCHEMBL15548928 0.77 FPR2 (0.79) FPR2PROKR1LMNAALDH1A1
SCHEMBL15549092 0.76 FPR2 (1.00) FPR2PROKR1
SCHEMBL15550341 0.76 FPR2 (1.00) FPR2PROKR1
SCHEMBL15549032 0.76 FPR2 (1.00) FPR2PROKR1
SCHEMBL15549371 0.76 FPR2 (1.00) FPR2PROKR1LMNA
SCHEMBL15549733 0.75 FPR2 (1.00) FPR2PROKR1
SCHEMBL15550145 0.75 FPR2 (0.66) FPR2PROKR1LMNA
SCHEMBL15548339 0.75 FPR2 (1.00) FPR2PROKR1
SCHEMBL15549438 0.75 FPR2 (1.00) FPR2PROKR1

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-20080306069-A1 Pyrazole Derivatives for the Inhibition of CDK'S and GSK'S ASTEX THERAPEUTICS LIMITED (UK) 2008-12-11 US disclosed
US-20080306069-A1 Pyrazole Derivatives for the Inhibition of CDK'S and GSK'S ASTEX THERAPEUTICS LIMITED (UK) 2008-12-11 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-20080306069-A1 Pyrazole Derivatives for the Inhibition of CDK'S and GSK'S GSK3A, CDK11A, CDK1 FPR2 4574/4885PROKR1 1805/4885TP53 469/4885

“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.