SCHEMBL5960202

SCHEMBL5960202

O=C(O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 19/20 0.81
MMP3 P08254 12/20 0.81
POLB P06746 1/20 0.75
APOBEC3A P31941 1/20 0.75
APOBEC3G Q9HC16 1/20 0.75
TDP1 Q9NUW8 1/20 0.75
L3MBTL1 Q9Y468 1/20 0.75

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
SCHEMBL4308168 1.00 MMP8 (0.81) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL6889052 0.89 MMP8 (0.66) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL8346417 0.89 MMP8 (0.84) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL6889057 0.89 MMP8 (0.66) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL31685698 0.88 MMP8 (0.76) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL26616352 0.88 MMP8 (0.76) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL26616353 0.88 MMP8 (0.76) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL6010087 0.86 MMP8 (0.82) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL13856619 0.85 POLB (0.72) MMP8MMP3POLBAPOBEC3AAPOBEC3G
SCHEMBL5960179 0.85 POLB (0.69) MMP8MMP3POLBAPOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7060832-B2 Nitrogen-containing fused heterocyclic carboxylic acids having an absolute configuration of “R” TANABE SEIYAKU CO., LTD. (JP) 2006-06-13 US claimed
EP-1236728-B1 S-type 2-substituted hydroxy-2-indolinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO (JP) 2006-07-05 EP disclosed
US-7060832-B2 Nitrogen-containing fused heterocyclic carboxylic acids having an absolute configuration of “R” TANABE SEIYAKU CO., LTD. (JP) 2006-06-13 US disclosed
EP-1528062-A2 Process for the preparation of s-type 4-substituted hydroxypyranoindolidine compounds TANABE SEIYAKU CO., LTD. (JP) 2005-05-04 EP disclosed
US-6716983-B2 S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 2004-04-06 US disclosed
WO-2003074489-A1 CYCLIC N-SUBSTITUTED ALPHA IMINOCARBOXYLIC ACIDS FOR SELECTIVELY INHIBITING COLLAGENASE AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-09-12 WO disclosed
EP-0845464-B1 S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds as intermediates for camptothecin derivatives TANABE SEIYAKU CO (JP) 2003-08-13 EP disclosed
US-20030135049-A1 S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO., LTD. 2003-07-17 US disclosed
US-20020161231-A1 Stype 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO., LTD. 2002-10-31 US disclosed
EP-1236728-A2 S-type 2-substituted hydroxy-2-indolinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 2002-09-04 EP disclosed
US-6388078-B1 CHEMICAL INTERMEDIATE FOR A CAMPTOTHECIN COMPOUND TANABE SEIYAKU COMPANY, LIMITED (JP) 2002-05-14 US disclosed
US-6277992-B1 USEFUL AS AN INTERMEDIATE FOR PREPARING CAMPTOTHECIN DERIVATIVES HAVING ANTITUMOR ACTIVITIES TANABE SEIYAKU CO., LTD. (JP) 2001-08-21 US disclosed
US-6114529-A USEFUL FOR PREPARING CAMPTOTHECIN DERIVATIVES HAVING ANTITUMOR ACTIVITIES TANABE SEIYAKU CO., LTD. (JP) 2000-09-05 US disclosed
US-6015901-A INTERMEDIATES FOR ANTITUMOR AGENTS TANABE SEIYAKU CO., LTD. (JP) 2000-01-18 US disclosed
US-5932732-A S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1999-08-03 US disclosed
EP-0845464-A2 S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds as intermediates for camptothecin derivatives TANABE SEIYAKU CO., LTD. (JP) 1998-06-03 EP 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 (2 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-20020161231-A1 Stype 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TOP2B, TOP2A, SI MMP8 4636/4885MMP3 4487/4885POLB 208/4885
US-20030135049-A1 S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TOP2B, TOP2A, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 MMP8 4624/4885MMP3 4807/4885POLB 299/4885

“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.