SCHEMBL4480386

SCHEMBL4480386

CC(=O)Nc1cccc2cc(S(=O)(=O)NCc3ccc(C(C)(C)C)cc3)ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.58
HDAC3 O15379 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
NLRP3 Q96P20 1/20 0.52
SLC2A1 P11166 1/20 0.48
NAMPT P43490 1/20 0.48
TRPV1 Q8NER1 2/20 0.48
ALDH1A1 P00352 5/20 0.47
HPGD P15428 1/20 0.47
POLB P06746 1/20 0.47
LMNA P02545 3/20 0.46
HTT P42858 2/20 0.46
EPHX2 P34913 1/20 0.45
GAA P10253 1/20 0.45
CYP19A1 P11511 1/20 0.44
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
THRB P10828 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL6907200 0.88 CASP6 (0.61) CASP6ALDH1A1POLBLMNAHTT
SCHEMBL4483879 0.88 CASP6 (0.64) CASP6HDAC8HDAC6POLBLMNA
SCHEMBL6906511 0.86 CASP6 (0.59) CASP6ALDH1A1POLBLMNAHTT
SCHEMBL4472758 0.84 HDAC3 (0.54) HDAC3HDAC8HDAC6SLC2A1NAMPT
SCHEMBL4556308 0.83 CASP6 (0.58) CASP6TRPV1ALDH1A1HPGDPOLB
SCHEMBL6909638 0.83 CASP6 (0.58) CASP6TRPV1ALDH1A1POLBLMNA
SCHEMBL4472720 0.82 HDAC3 (0.51) HDAC3HDAC8HDAC6SLC2A1NAMPT
SCHEMBL4483306 0.82 EPHX2 (0.49) HDAC3HDAC8HDAC6SLC2A1NAMPT
SCHEMBL4483600 0.81 LMNA (0.59) HDAC3HDAC8HDAC6SLC2A1NAMPT
SCHEMBL4493195 0.81 NSD2 (0.52) HDAC3HDAC8HDAC6SLC2A1NAMPT

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 CASP6 381/4885HDAC3 16/4885HDAC8 36/4885

“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.