SCHEMBL2963543

SCHEMBL2963543

CCCCCCC(NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 14/20 0.76
SIRT1 Q96EB6 9/20 0.76
CTSL P07711 1/20 0.65
CTSS P25774 1/20 0.65
SIRT3 Q9NTG7 6/20 0.65
TGM2 P21980 1/20 0.60
MME P08473 1/20 0.59
ECE1 P42892 1/20 0.59
FOLH1 Q04609 1/20 0.58

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
SCHEMBL4787188 1.00 SIRT2 (0.76) SIRT2SIRT1CTSLCTSSSIRT3
SCHEMBL21357647 1.00 SIRT2 (0.76) SIRT2SIRT1CTSLCTSSSIRT3
SCHEMBL7689520 1.00 SIRT2 (0.76) SIRT2SIRT1CTSLCTSSSIRT3
SCHEMBL17279329 0.99 SIRT2 (0.74) SIRT2SIRT1CTSLCTSSSIRT3
SCHEMBL11308449 0.99 SIRT2 (0.74) SIRT2SIRT1CTSLCTSSSIRT3
SCHEMBL17694104 0.99 SIRT2 (0.74) SIRT2SIRT1CTSLCTSSSIRT3
SCHEMBL150166 0.95 CTSL (0.72) SIRT2SIRT1CTSLCTSSSIRT3
SCHEMBL11332452 0.95 CTSL (0.72) SIRT2SIRT1CTSLCTSSSIRT3
SCHEMBL4126228 0.95 CTSL (0.72) SIRT2SIRT1CTSLCTSSSIRT3
Hydrochloric Acid SCHEMBL4438043 0.93 CTSL (0.70) SIRT2SIRT1CTSLCTSSSIRT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119371328-A Preparation method of 8-amino octanoic acid 苏州昊帆生物股份有限公司 2025-01-28 CN claimed
CN-119371328-A Preparation method of 8-amino octanoic acid 苏州昊帆生物股份有限公司 2025-01-28 CN disclosed
US-20210085798-A1 IMMUNITY LINKER MOLECULES AND THEIR USE IN THE TREATMENT OF INFECTIOUS DISEASES CENTAURI THERAPEUTICS LIMITED (GB) 2021-03-25 US disclosed
EP-3765155-A1 IMMUNITY LINKER MOLECULES AND THEIR USE IN THE TREATMENT OF INFECTIOUS DISEASES Centauri Therapeutics Limited (GB) 2021-01-20 EP disclosed
WO-2019175590-A1 IMMUNITY LINKER MOLECULES AND THEIR USE IN THE TREATMENT OF INFECTIOUS DISEASES CENTAURI THERAPEUTICS LIMITED (GB) 2019-09-19 WO disclosed
US-7767811-B2 Kinetic resolutions of chiral 2- and 3-substituted carboxylic acids BRANDEIS UNIVERSITY (US) 2010-08-03 US disclosed
US-20060293536-A1 Kinetic resolutions of chiral 2- and 3-substituted carboxylic acids BRANDEIS UNIVERSITY (US) 2006-12-28 US disclosed
US-7057038-B2 Kinetic resolutions of chiral 2- and 3-substituted carboxylic acids BRANDEIS UNIVERSITY (US) 2006-06-06 US disclosed
EP-1419125-A4 KINETIC RESOLUTIONS OF CHIRAT 3- AND 3-SUBSTITUTED CARBOXYLIC ACIDS UNIV BRANDEIS (US) 2005-03-23 EP disclosed
US-20050020849-A1 Kinetic resolutions of chiral 2- and 3-substituted carboxylic acids DENG LI (US) 2005-01-27 US disclosed
EP-1305270-B1 KINETIC RESOLUTIONS OF CHIRAL 2- AND 3-SUBSTITUTED CARBOXYLIC ACIDS UNIV BRANDEIS (US) 2004-04-14 EP disclosed
US-20030166963-A1 Kinetic resolutions of chiral 2-and 3-substituted carboxylic acids NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-09-04 US disclosed
US-6562967-B2 Drug screening; purity BRANDEIS UNIVERSITY 2003-05-13 US disclosed
EP-1305270-A1 KINETIC RESOLUTIONS OF CHIRAL 2- AND 3-SUBSTITUTED CARBOXYLIC ACIDS Brandeis University (US) 2003-05-02 EP disclosed
WO-2003011799-A1 KINETIC RESOLUTIONS OF CHIRAT 3- AND 3-SUBSTITUTED CARBOXYLIC ACIDS BRANDEIS UNIVERSITY (US) 2003-02-13 WO disclosed
US-20020165393-A1 Kinetic resolutions of chiral 2- and 3-substituted carboxylic acids NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-11-07 US disclosed
US-20020151744-A1 Kinetic resolutions of chiral 2-and-3-substituted carboxylic acids NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-10-17 US disclosed
WO-2002010096-A1 KINETIC RESOLUTIONS OF CHIRAL 2- AND 3-SUBSTITUTED CARBOXYLIC ACIDS BRANDEIS UNIVERSITY (US) 2002-02-07 WO disclosed
EP-0932619-A1 MACROCYCLIC PEPTIDES USEFUL IN THE TREATMENT OF THROMBIN RELATED DISORDERS Ortho-McNeil Pharmaceutical, Inc. (US) 1999-08-04 EP disclosed
WO-1997030080-A1 MACROCYCLIC PEPTIDES USEFUL IN THE TREATMENT OF THROMBIN RELATED DISORDERS ORTHO PHARMACEUTICAL CORPORATION (US) 1997-08-21 WO 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 (6 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-20020165393-A1 Kinetic resolutions of chiral 2- and 3-substituted carboxylic acids ADH5, ADH1C, TST SIRT2 4038/4885SIRT1 4474/4885CTSL 3226/4885
US-20050020849-A1 Kinetic resolutions of chiral 2- and 3-substituted carboxylic acids ADH5, ADH1C, TST SIRT2 4154/4885SIRT1 4495/4885CTSL 3302/4885
US-20060293536-A1 Kinetic resolutions of chiral 2- and 3-substituted carboxylic acids ADH5, ADH1C, TST SIRT2 4154/4885SIRT1 4495/4885CTSL 3302/4885
US-20030166963-A1 Kinetic resolutions of chiral 2-and 3-substituted carboxylic acids ADH5, ADH1C, TST SIRT2 4058/4885SIRT1 4509/4885CTSL 3348/4885
US-20020151744-A1 Kinetic resolutions of chiral 2-and-3-substituted carboxylic acids ADH5, ADH1C, TST SIRT2 4236/4885SIRT1 4659/4885CTSL 3429/4885
US-20210085798-A1 IMMUNITY LINKER MOLECULES AND THEIR USE IN THE TREATMENT OF INFECTIOUS DISEASES MYD88, MAVS, TLR3 SIRT2 1140/4885SIRT1 1085/4885CTSL 360/4885

“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.