SCHEMBL5042853

SCHEMBL5042853

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

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.33
MEN1 O00255 5/20 0.33
MAPT P10636 4/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PTBP1 P26599 1/20 0.33
POLB P06746 1/20 0.32
ALDH1A1 P00352 5/20 0.32
EGFR P00533 2/20 0.32
MAPK1 P28482 2/20 0.32
GAA P10253 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ENPP1 P22413 3/20 0.31
ENPP2 Q13822 2/20 0.31
ENPP3 O14638 1/20 0.31
KCNH3 Q9ULD8 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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 0.90 EGFR (0.35) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL5036765 0.87 MEN1 (0.37) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL5036815 0.86 ENPP1 (0.35) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL5041026 0.84 MEN1 (0.37) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL5041060 0.84 ACE2 (0.35) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL5033719 0.82 MAPT (0.35) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL6018087 0.82 EGFR (0.35) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL14300397 0.82 TUBB4A (0.48) KMT2AMEN1LMNASMN1; SMN2MAPK1
SCHEMBL5140564 0.82 ACE2 (0.33) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL6017783 0.81 CA1 (0.37) KMT2AMEN1MAPTLMNASMN1; 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 3 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

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 KMT2A 2114/4885MEN1 3925/4885MAPT 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.