SCHEMBL4867720

SCHEMBL4867720

COc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(Cl)cc2Cc2c(F)cccc2OC)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
MAPT P10636 2/20 0.49
MEP1B Q16820 1/20 0.48
F2 P00734 2/20 0.47
KMT2A Q03164 2/20 0.46
TMPRSS6 Q8IU80 1/20 0.45
TSHR P16473 2/20 0.44
TP53 P04637 2/20 0.44
MAPK1 P28482 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
PKM P14618 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 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
SCHEMBL3256517 0.96 ALDH1A1 (0.51) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL4863941 0.94 ALDH1A1 (0.48) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL3256933 0.91 MAPK1 (0.49) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL3253072 0.90 MEP1B (0.52) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL3252976 0.90 ALDH1A1 (0.49) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL4863480 0.90 ALDH1A1 (0.53) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL3249493 0.89 MAPK1 (0.51) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL3253388 0.89 MEP1B (0.53) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL3247120 0.89 ALDH1A1 (0.52) ALDH1A1MAPTMEP1BF2KMT2A
SCHEMBL3250405 0.88 NPC1 (0.48) ALDH1A1MAPTF2KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7396958-B2 Sulphonamide derivatives, their preparation and their therapeutic application SANOFI AVENTIS (FR) 2008-07-08 US disclosed
US-20070185136-A1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2007-08-09 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-20070185136-A1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION HCRTR2, GIPR, SSTR2 ALDH1A1 2179/4885MAPT 3113/4885MEP1B 1627/4885

“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.