SCHEMBL4471119

SCHEMBL4471119

CC(=O)Oc1cccc2cc(S(=O)(=O)NCCc3ccccc3)ccc12

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.53
ALDH1A1 P00352 4/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
MAPT P10636 2/20 0.49
SGMS1 Q86VZ5 2/20 0.49
PRMT1 Q99873 1/20 0.49
POLB P06746 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
GAA P10253 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL4482883 0.89 CYP19A1 (0.53) ALDH1A1KMT2AHDAC2HDAC8HDAC6
SCHEMBL4483653 0.81 CYP19A1 (0.53) PRMT1POLBLMNA
SCHEMBL4480492 0.81 CYP2C9 (0.53) AKR1C3ALDH1A1MEN1KMT2AHDAC2
SCHEMBL4479458 0.80 CA2 (0.45) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL4489568 0.80 AKR1C3 (0.57) AKR1C3ALDH1A1MEN1KMT2ANPSR1
SCHEMBL4490023 0.79 CYP19A1 (0.57) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL4472720 0.78 HDAC3 (0.51) ALDH1A1HDAC8HDAC6POLBGAA
SCHEMBL4482164 0.78 ATM (0.54) ALDH1A1PRMT1POLBGAALMNA
SCHEMBL4465917 0.77 CYP19A1 (0.52) ALDH1A1MAPTPOLBLMNA
SCHEMBL4492227 0.77 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ANPSR1MAPT

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 AKR1C3 1622/4885ALDH1A1 1461/4885MEN1 4507/4885

“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.