SCHEMBL4881731

SCHEMBL4881731

CC1(C)C(=O)N(c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1Cc1ccncc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 7/20 0.57
NAMPT P43490 3/20 0.48
LMNA P02545 2/20 0.46
ALDH1A1 P00352 4/20 0.46
USP2 O75604 3/20 0.46
TAS2R8 Q9NYW2 1/20 0.46
MAPT P10636 1/20 0.44
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 2/20 0.43
CYP2C9 P11712 2/20 0.43
TSHR P16473 2/20 0.43
TP53 P04637 1/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL4881494 0.83 IGF1R (0.62) IGF1RTAS2R8
SCHEMBL4889027 0.81 IGF1R (0.60) IGF1RNAMPTTAS2R8
SCHEMBL3008275 0.81 IGF1R (0.68) IGF1RTAS2R8
SCHEMBL4884432 0.80 IGF1R (0.58) IGF1RLMNAALDH1A1TAS2R8KMT2A
SCHEMBL1773931 0.79 TSHR (0.45) IGF1RNAMPTLMNAALDH1A1USP2
SCHEMBL13039129 0.78 IGF1R (0.67) IGF1RALDH1A1TAS2R8CYP3A4CYP2D6
SCHEMBL4884448 0.77 IGF1R (0.55) IGF1RTAS2R8
Trifluoroacetic Acid SCHEMBL4890244 0.77 IGF1R (0.60) IGF1RNAMPT
SCHEMBL2937078 0.76 IGF1R (0.75) IGF1RTAS2R8
SCHEMBL13039186 0.76 IGF1R (0.68) IGF1RTAS2R8

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080021029-A1 Substituted Cyclic Urea Derivatives, Preparation Thereof And Pharmaceutical Use Thereof As Kinase Inhibitors AVENTIS PHARMA S.A. (FR) 2008-01-24 US disclosed
EP-1773809-A1 SUBSTITUTED CYCLIC UREA DERIVATIVES, PREPARATION THEREOF AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2007-04-18 EP disclosed
WO-2006010643-A1 SUBSTITUTED CYCLIC UREA DERIVATIVES, PREPARATION THEREOF AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2006-02-02 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-20080021029-A1 Substituted Cyclic Urea Derivatives, Preparation Thereof And Pharmaceutical Use Thereof As Kinase Inhibitors PRKAR2B, PRKG2, PRKG1 IGF1R 878/4885NAMPT 2443/4885LMNA 2251/4885

“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.