SCHEMBL4487552

SCHEMBL4487552

Nc1ccc2c(S(=O)(=O)NCc3ccccc3)cccc2c1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 10/20 0.63
NPY5R Q15761 2/20 0.57
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49
CYP19A1 P11511 1/20 0.49
LMNA P02545 1/20 0.47
SLC12A2 P55011 1/20 0.47
SLC12A5 Q9H2X9 1/20 0.47
KEAP1 Q14145 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
Hydrochloric Acid SCHEMBL4493664 0.99 NSD2 (0.64) NSD2NPY5RCA12CA9CYP19A1
Hydrochloric Acid SCHEMBL6909699 0.87 FABP4 (0.51) NSD2NPY5RCA12CA9L3MBTL1
SCHEMBL4482603 0.86 NSD2 (0.53) NSD2NPY5RCYP19A1
SCHEMBL20026077 0.84 NSD2 (0.70) NSD2NPY5RCA12CA9KEAP1
SCHEMBL8913909 0.78 KMT2A (0.66) NSD2NPY5RLMNAMAPK1
SCHEMBL14919840 0.78 SLC6A9 (0.43) LMNAALDH1A1
SCHEMBL4474391 0.78 NSD2 (0.49) NSD2NPY5RCA12CA9LMNA
SCHEMBL7457681 0.77 NPY5R (0.64) NSD2NPY5RCA9ALDH1A1
SCHEMBL4441197 0.77 NSD2 (1.00) NSD2NPY5R
SCHEMBL9226619 0.77 PLAU (0.46) NSD2CA9LMNAALDH1A1L3MBTL1

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
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 NSD2 639/4885NPY5R 1984/4885CA12 1796/4885

“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.