SCHEMBL1523032

SCHEMBL1523032

Nc1ccc(-c2ccccc2)cc1S(N)(=O)=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.55
CA9 Q16790 8/20 0.55
CA1 P00915 7/20 0.55
CA12 O43570 6/20 0.55
CA7 P43166 3/20 0.55
CA4 P22748 2/20 0.55
CA6 P23280 2/20 0.55
CA5A P35218 2/20 0.55
CA14 Q9ULX7 2/20 0.55
CA5B Q9Y2D0 2/20 0.55
CYP2C9 P11712 1/20 0.55
GAA P10253 2/20 0.50
HSD17B10 Q99714 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
HSP90AA1 P07900 1/20 0.50
MAPT P10636 1/20 0.50

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
SCHEMBL11122407 0.86 CA2 (0.55) CA2CA9CA1CA12CA7
SCHEMBL27932746 0.83 IKBKB (0.47) CA2CA9CA1CA12CA7
SCHEMBL5973210 0.83 IKBKB (0.51) CA2CA9CA1CA12GAA
SCHEMBL11289740 0.81 CA2 (0.53) CA2CA9CA1CA12CA7
SCHEMBL11676493 0.76 CA1 (0.48) CA2CA9CA1CA12CA7
SCHEMBL813100 0.76 CA2 (0.52) CA2CA9CA1CA12CA7
SCHEMBL15571015 0.75 CA2 (0.53) CA2CA9CA1CA12CA7
SCHEMBL38653675 0.75 PKM (0.58) CA2CA9CA1CA12CA4
SCHEMBL10864194 0.75 PKM (0.58) CA2CA9CA1CA12CA4
SCHEMBL27378810 0.75 CA2 (0.47) CA2CA9CA1CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2361913-A1 Anti-infective agents Abbott Laboratories (US) 2011-08-31 EP disclosed
US-7902203-B2 Anti-infective agents ABBOTT LABORATORIES, INC. (US) 2011-03-08 US disclosed
EP-1560827-B1 ANTI-INFECTIVE AGENTS ABBOTT LAB (US) 2010-12-29 EP disclosed
EP-1560827-A1 ANTI-INFECTIVE AGENTS Abbott Laboratories (US) 2005-08-10 EP disclosed
US-20050075331-A1 Anti-infective agents ABBOTT LABORATORIES 2005-04-07 US disclosed
US-20040167123-A1 Anti-infective agents ABBVIE INC. 2004-08-26 US disclosed
US-20040162285-A1 Anti-infective agents ABBOTT LABORATORIES 2004-08-19 US disclosed
WO-2004041818-A1 ANTI-INFECTIVE AGENTS ABBOTT LABORATORIES (US) 2004-05-21 WO disclosed
US-20040097492-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-20 US disclosed
US-20040087577-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-06 US disclosed
CN-1443160-A N-substituted-1-amino-1,1-dialkyl carboxylic acid derivatives MERCK PATENT GMBH (DE) 2003-09-17 CN 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 (5 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-20040097492-A1 Anti-infective agents POLR1C, RPL5, POLB CA2 4395/4885CA9 3535/4885CA1 4367/4885
US-20040162285-A1 Anti-infective agents POLR1C, RPL5, POLB CA2 4395/4885CA9 3535/4885CA1 4367/4885
US-20040167123-A1 Anti-infective agents SERPINB1, CYP51A1, ZC3HAV1 CA2 4484/4885CA9 4098/4885CA1 4607/4885
US-20050075331-A1 Anti-infective agents RPL35, POLI, POLRMT CA2 4440/4885CA9 4070/4885CA1 4765/4885
US-20040087577-A1 Anti-infective agents POLR1C, RPL5, POLB CA2 4395/4885CA9 3535/4885CA1 4367/4885

“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.