SCHEMBL5036765

SCHEMBL5036765

CC(C)Nc1ccc(S(=O)(=O)Oc2ccc3[nH]c(N(C)C(=O)O)nc3c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 4/20 0.37
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
PTBP1 P26599 1/20 0.37
ALDH1A1 P00352 5/20 0.35
RECQL P46063 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HSP90AA1 P07900 1/20 0.35
EGFR P00533 1/20 0.35
HTT P42858 2/20 0.34
ENPP1 P22413 5/20 0.34
ENPP2 Q13822 4/20 0.34
ENPP3 O14638 4/20 0.34
HPGD P15428 1/20 0.33
ADAMTS4 O75173 1/20 0.33
MCHR1 Q99705 1/20 0.33

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
SCHEMBL6017774 0.91 EGFR (0.35) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5041026 0.89 MEN1 (0.37) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5042853 0.87 KMT2A (0.33) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL6018087 0.87 EGFR (0.35) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5036815 0.86 ENPP1 (0.35) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5035960 0.85 ENPP3 (0.39) MAPTHTTENPP1ENPP2ENPP3
SCHEMBL5035909 0.85 L3MBTL1 (0.35) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5041060 0.85 ACE2 (0.35) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5042900 0.83 MET (0.40) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5033719 0.83 MAPT (0.35) MEN1KMT2AMAPTLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1432417-B1 SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCER AVENTIS PHARMA SA (FR) 2008-02-20 EP disclosed
US-7041668-B2 Substituted benzimidazole compounds and their use for the treatment of cancer AVENTIS PHARMA S.A. (FR) 2006-05-09 US disclosed
US-20050014811-A1 Substituted benzimidazole compounds and their use for the treatment of cancer AVENTIS PHARMA S.A. (FR) 2005-01-20 US disclosed
EP-1298125-A1 Substituted benzimidazole compounds and their use for the treatment of cancer Aventis Pharma S.A. (FR) 2003-04-02 EP 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-20050014811-A1 Substituted benzimidazole compounds and their use for the treatment of cancer CDKL3, CCNL2, CDKL1 MEN1 3925/4885KMT2A 2114/4885MAPT 4854/4885

“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.