SCHEMBL3092274

SCHEMBL3092274

CC(=N)NCc1cccc2cc(S(=O)(=O)c3ccccc3)ccc12

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.46
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
NQO2 P16083 4/20 0.42
MTNR1A P48039 4/20 0.41
MTNR1B P49286 3/20 0.41
CYP2C9 P11712 1/20 0.41
NAMPT P43490 1/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
CASP6 P55212 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA4 P22748 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL3088528 0.89 NQO2 (0.51) CA2MEN1MAPTKMT2ANQO2
SCHEMBL3086379 0.88 CA2 (0.49) CA2MEN1MAPTKMT2ANQO2
SCHEMBL3092580 0.84 CA2 (0.50) CA2MEN1MAPTKMT2AMTNR1A
SCHEMBL3097281 0.83 HTR6 (0.43) CA2MAPTNQO2CASP6CA12
SCHEMBL3080740 0.82 CA2 (0.44) CA2MEN1MAPTKMT2ANQO2
SCHEMBL14344711 0.82 CA2 (0.48) CA2MEN1MAPTKMT2ACYP2C9
SCHEMBL3092172 0.81 NQO2 (0.48) CA2MEN1MAPTKMT2ANQO2
SCHEMBL3090844 0.81 NQO2 (0.47) CA2MEN1MAPTKMT2ANQO2
SCHEMBL3096948 0.79 HTR6 (0.49) CA2NQO2MTNR1AMTNR1BNAMPT
SCHEMBL4006731 0.78 KDM4E (0.44) CA2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799797-B2 Arylsulfonyl naphthalene derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2010-09-21 US disclosed
CN-101472885-A Arylsulfonyl naphthalene derivatives and uses thereof HOFFMANN LA ROCHE (CH) 2009-07-01 CN disclosed
EP-2041079-A1 ARYLSULFONYL NAPHTHALENE DERIVATIVES AND USES THEREOF F. Hoffmann-Roche AG (CH) 2009-04-01 EP disclosed
WO-2007147763-A1 ARYLSULFONYL NAPHTHALENE DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2007-12-27 WO disclosed
US-20070293526-A1 Arylsulfonyl naphthalene derivatives and uses thereof ROCHE PALO ALTO LLC 2007-12-20 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-20070293526-A1 Arylsulfonyl naphthalene derivatives and uses thereof ARSA, AR, SULT2A1 CA2 4084/4885MEN1 470/4885MAPT 4183/4885

“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.