SCHEMBL5033498

SCHEMBL5033498

CC(=O)Nc1ccc(CNc2ccc(S(=O)(=O)Oc3ccc4[nH]c(NC(=O)C5CC5)nc4c3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 11/20 0.44
ENPP1 P22413 10/20 0.44
ENPP2 Q13822 7/20 0.44
MAPT P10636 2/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PTPN1 P18031 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL5037833 0.93 ENPP1 (0.51) ENPP3ENPP1ENPP2MAPTSMN1; SMN2
SCHEMBL5036479 0.93 ULK1 (0.45) ENPP3ENPP1ENPP2SMN1; SMN2MEN1
SCHEMBL5036147 0.91 SMN1; SMN2 (0.42) ENPP3ENPP1ENPP2SMN1; SMN2
SCHEMBL5043081 0.91 SMN1; SMN2 (0.48) ENPP3ENPP1ENPP2MAPTSMN1; SMN2
SCHEMBL5040856 0.91 TP53 (0.42) ENPP3ENPP1ENPP2MAPTSMN1; SMN2
SCHEMBL5040722 0.90 SMN1; SMN2 (0.42) ENPP3ENPP1ENPP2SMN1; SMN2
SCHEMBL5036505 0.90 SMN1; SMN2 (0.43) ENPP3ENPP1ENPP2SMN1; SMN2
SCHEMBL5037697 0.87 SMN1; SMN2 (0.47) ENPP3ENPP1ENPP2MAPTSMN1; SMN2
SCHEMBL5036560 0.87 SMN1; SMN2 (0.43) ENPP3ENPP1ENPP2SMN1; SMN2
SCHEMBL5036631 0.87 KMT2A (0.45) ENPP3ENPP1ENPP2MAPTSMN1; 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 ENPP3 2927/4885ENPP1 3915/4885ENPP2 2109/4885

“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.