SCHEMBL3013315

SCHEMBL3013315

O=C(O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.92

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.92
ADAMTS5 Q9UNA0 1/20 0.92
MMP9 P14780 11/20 0.79
ADAMTS4 O75173 1/20 0.79
ALDH1A1 P00352 1/20 0.70
MAPT P10636 1/20 0.70
MMP1 P03956 1/20 0.70
MMP3 P08254 1/20 0.70
MMP7 P09237 1/20 0.70
MMP13 P45452 1/20 0.70
POLB P06746 1/20 0.66
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
TDP1 Q9NUW8 1/20 0.59

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
SCHEMBL3009406 1.00 MMP2 (0.92) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL3009401 1.00 MMP2 (0.92) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL29527231 0.94 MMP2 (0.82) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL3890915 0.90 MMP2 (0.76) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL3890918 0.90 MMP2 (0.76) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL697592 0.90 MMP2 (0.85) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL697591 0.90 MMP2 (0.85) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL4188026 0.90 MMP2 (0.85) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL6418857 0.89 MMP2 (0.74) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1
SCHEMBL6418848 0.89 MMP2 (0.74) MMP2ADAMTS5MMP9ADAMTS4ALDH1A1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100197749-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB 2010-08-05 US disclosed
US-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-30 US disclosed
EP-2013184-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS AstraZeneca AB (SE) 2009-01-14 EP disclosed
EP-1979332-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2008-10-15 EP disclosed
WO-2007129019-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2007-11-15 WO disclosed
EP-1377542-B1 HIV PROTEASE INHIBITORS BASED ON AMINO ACID DERIVATIVES AMBRILIA BIOPHARMA INC (CA) 2007-08-01 EP disclosed
WO-2007083089-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2007-07-26 WO disclosed
EP-1803706-A1 HIV protease inhibitors based on amino acid derivatives Ambrilia Biopharma Inc. (CA) 2007-07-04 EP disclosed
US-6677367-B2 LYSINE DERIVATIVE WITH 2-AMINOSULFONYLTHIOPHENE SUBSTITUENT; ACQUIRED IMMUNODEFICIENCY SYNDROME (AIDS) VIRICIDES PHARMACOR INC. (CA) 2004-01-13 US disclosed
EP-1377542-A1 HIV PROTEASE INHIBITORS BASED ON AMINO ACID DERIVATIVES Pharmacor Inc. (CA) 2004-01-07 EP disclosed
US-20030144265-A1 HIV protease inhibitors based on amino acid derivatives TAIMED BIOLOGICS, INC. (TW) 2003-07-31 US disclosed
US-20030119803-A1 HIV protease inhibitors based on amino acid derivatives TAIMED BIOLOGICS, INC. (TW) 2003-06-26 US disclosed
US-6506786-B2 Such as N-isobutyl-N-(4-methylbenzene-sulfonyl)-N-(N-(4-methylbenzenesulfonyl)-L -phenylalanyl)-L-lysine PHARMACOR INC. (CA) 2003-01-14 US disclosed
US-20020151546-A1 HIV protease inhibitors based on amino acid derivatives TAIMED BIOLOGICS, INC. (TW) 2002-10-17 US disclosed
WO-2002064551-A1 HIV PROTEASE INHIBITORS BASED ON AMINO ACID DERIVATIVES PHARMACOR INC. (CA) 2002-08-22 WO disclosed
US-5792869-A REACTING PIPERAZINE DERIVATIVE WITH SULFONAMIDE DERIVATIVE OF OPTICALLY ACTIVE AMINO ACID, PRECIPITATING LESS SOLUBLE SALT, SEPARATING, DECOMPOSING TO DESIRED DIASTEREOMER YAMAKAWA CHEMICAL INDUSTRY CO., LTD (JP) 1998-08-11 US disclosed
EP-0710652-B1 Process for preparing optically active piperazine derivatives and intermediates for preparation YAMAKAWA CHEMICAL IND (JP) 1998-03-04 EP disclosed
US-5650428-A THROMBOXANE A2 ANTAGONISM NKK CORPORATION (JP) 1997-07-22 US disclosed
EP-0710652-A2 Process for preparing optically active piperazine derivatives and intermediates for preparation YAMAKAWA CHEMICAL INDUSTRY CO., LTD. (JP) 1996-05-08 EP disclosed
CN-1111453-A Aryl sulfonamide derivatives and pharmaceutical compositions containing the same NIPPON KOKAN KK (JP) 1995-11-08 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-20030144265-A1 HIV protease inhibitors based on amino acid derivatives ANPEP, PEPD, XPNPEP1 MMP2 845/4885ADAMTS5 3651/4885MMP9 732/4885
US-20020151546-A1 HIV protease inhibitors based on amino acid derivatives ANPEP, PEPD, XPNPEP1 MMP2 845/4885ADAMTS5 3651/4885MMP9 732/4885
US-20100197749-A1 CHEMICAL COMPOUNDS EDF1, ECE1, EDNRA MMP2 2309/4885ADAMTS5 582/4885MMP9 3346/4885
US-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ADGRE5, ADGRF1, SELPLG MMP2 3625/4885ADAMTS5 891/4885MMP9 3153/4885
US-20030119803-A1 HIV protease inhibitors based on amino acid derivatives ANPEP, PEPD, XPNPEP1 MMP2 845/4885ADAMTS5 3651/4885MMP9 732/4885

“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.