SCHEMBL5036256

SCHEMBL5036256

COCCCNc1ccc(S(=O)(=O)Oc2ccc3[nH]c(N(C)C(=O)O)nc3c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.37
CDK9 P50750 1/20 0.37
KDM4E B2RXH2 4/20 0.35
POLB P06746 3/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 3/20 0.34
HPGD P15428 1/20 0.34
BRAF P15056 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
PKM P14618 1/20 0.34
LMNA P02545 1/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.33
FBP1 P09467 1/20 0.33
ENPP2 Q13822 2/20 0.33
ENPP3 O14638 2/20 0.33
ENPP1 P22413 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAPK1 P28482 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
SCHEMBL5042900 0.95 MET (0.40) METCDK9ALDH1A1KMT2ASMN1; SMN2
SCHEMBL5033719 0.91 MAPT (0.35) KDM4EPOLBALDH1A1KMT2AHPGD
SCHEMBL5140564 0.90 ACE2 (0.33) METCDK9ALDH1A1KMT2ASMN1; SMN2
SCHEMBL5041060 0.89 ACE2 (0.35) METCDK9KDM4EPOLBALDH1A1
SCHEMBL5036815 0.87 ENPP1 (0.35) KDM4EALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL6017783 0.86 CA1 (0.37) KDM4EPOLBALDH1A1KMT2ASMN1; SMN2
SCHEMBL5033506 0.86 RORC (0.39) KDM4EPOLBALDH1A1KMT2AMEN1
SCHEMBL5041026 0.84 MEN1 (0.37) METCDK9KDM4EALDH1A1KMT2A
SCHEMBL6018087 0.84 EGFR (0.35) KDM4EALDH1A1KMT2ABRAFSMN1; SMN2
SCHEMBL5036159 0.83 ALDH1A1 (0.35) KDM4EALDH1A1KMT2ASMN1; SMN2LMNA

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 MET 294/4885CDK9 136/4885KDM4E 1962/4885

“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.