SCHEMBL4477096

SCHEMBL4477096

CC(=O)Oc1cccc2cc(S(=O)(=O)NCc3ccc(C)o3)ccc12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.39
CYP19A1 P11511 2/20 0.38
ALDH1A1 P00352 4/20 0.38
PKM P14618 2/20 0.37
GAA P10253 1/20 0.37
SCN9A Q15858 2/20 0.37
MAPT P10636 2/20 0.37
MCL1 Q07820 1/20 0.37
HTR6 P50406 1/20 0.36
CASP6 P55212 1/20 0.36

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
SCHEMBL4479454 0.83 CYP19A1 (0.42) POLBCYP19A1ALDH1A1PKMGAA
SCHEMBL4482883 0.82 CYP19A1 (0.53) POLBCYP19A1ALDH1A1PKMGAA
SCHEMBL4479458 0.80 CA2 (0.45) POLBCYP19A1ALDH1A1GAAMAPT
SCHEMBL4483653 0.78 CYP19A1 (0.53) POLBCYP19A1PKM
SCHEMBL4472720 0.78 HDAC3 (0.51) POLBCYP19A1ALDH1A1GAA
SCHEMBL4482164 0.78 ATM (0.54) POLBALDH1A1PKMGAAMCL1
SCHEMBL4485797 0.78 POLB (0.48) POLBPKMGAAMAPT
SCHEMBL4465917 0.77 CYP19A1 (0.52) POLBCYP19A1ALDH1A1SCN9AMAPT
SCHEMBL4478333 0.77 ALDH1A1 (0.50) ALDH1A1SCN9AMAPT
SCHEMBL4470624 0.76 SMN1; SMN2 (0.58) ALDH1A1MCL1

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
US-7598418-B2 Naphthalene-1-(sulfonamide or carboxamide) derivatives; e.g. N-Benzyl-5-{[(4-methylphenyl)sulfonyl]oxy}naphthalene-1-sulfonamide; protein kinase inhibitors sensitize cancer cells to radiotherapy or anticancer agents; side effect reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-10-06 US claimed
US-20050215645-A1 Amide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2005-09-29 US claimed
US-7598418-B2 Naphthalene-1-(sulfonamide or carboxamide) derivatives; e.g. N-Benzyl-5-{[(4-methylphenyl)sulfonyl]oxy}naphthalene-1-sulfonamide; protein kinase inhibitors sensitize cancer cells to radiotherapy or anticancer agents; side effect reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-10-06 US disclosed
US-20050215645-A1 Amide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2005-09-29 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-20050215645-A1 Amide derivatives OGG1, HDAC1, BCL2A1 POLB 296/4885CYP19A1 552/4885ALDH1A1 1461/4885

“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.