SCHEMBL1613533

SCHEMBL1613533

O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)[C@H]1CCC(=O)N1Cc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 9/20 0.77
ITGB1 P05556 10/20 0.58
ITGA4 P13612 10/20 0.58
P2RX7 Q99572 1/20 0.48

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
SCHEMBL288920 1.00 CAPN1 (0.77) CAPN1ITGB1ITGA4P2RX7
SCHEMBL1613008 1.00 CAPN1 (0.77) CAPN1ITGB1ITGA4P2RX7
SCHEMBL289303 0.96 CAPN1 (0.72) CAPN1ITGB1ITGA4P2RX7
SCHEMBL1612451 0.96 CAPN1 (0.72) CAPN1ITGB1ITGA4P2RX7
SCHEMBL1611219 0.96 CAPN1 (0.72) CAPN1ITGB1ITGA4P2RX7
SCHEMBL289125 0.95 CAPN1 (0.71) CAPN1ITGB1ITGA4P2RX7
SCHEMBL1612510 0.95 CAPN1 (0.71) CAPN1ITGB1ITGA4P2RX7
SCHEMBL1612978 0.95 CAPN1 (0.71) CAPN1ITGB1ITGA4P2RX7
SCHEMBL289012 0.92 CAPN1 (0.77) CAPN1ITGB1ITGA4P2RX7
SCHEMBL288801 0.92 CAPN1 (0.77) CAPN1ITGB1ITGA4P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427429-B1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS ABBVIE DEUTSCHLAND (DE) 2017-02-15 EP claimed
US-8236798-B2 Carboxamide compounds and their use as calpain inhibitors ABBOTT GMBH & CO. KG (DE) 2012-08-07 US claimed
EP-4682264-A1 ASSAY SYSTEM FOR DEVELOPING HONEYBEE ANTIVIRAL AGENT USING INHIBITION OF VIRUS-DERIVED PROTEASE AS INDICATOR Toyama Prefectural University (JP) 2026-01-21 EP disclosed
US-20230190701-A1 Compounds for Treating Tauopathies and Restless Leg Syndrome and Methods of Using and Screening for Same THE US GOV AS REPRESENTED (US) 2023-06-22 US disclosed
US-20220324814-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS INC (US) 2022-10-13 US disclosed
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 US disclosed
WO-2022026894-A1 COMPOUNDS FOR TREATING TAUOPATHIES AND RESTLESS LEG SYNDROME AND METHODS OF USING AND SCREENING FOR SAME UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS (US) 2022-02-03 WO disclosed
US-20220031653-A1 Compounds for Treating Tauopathies and Restless Leg Syndrome and Methods of Using and Screening for Same UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2022-02-03 US disclosed
US-20210113560-A1 METHOD OF TREATING FIBROTIC DISEASE BLADE THERAPEUTICS INC (US) 2021-04-22 US disclosed
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 US disclosed
US-10894776-B2 2021-01-19 US disclosed
EP-2427429-B1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS ABBVIE DEUTSCHLAND (DE) 2017-02-15 EP disclosed
US-9527811-B2 Carboxamide compounds and their use as calpain inhibitors AbbVie Deutschland GmbH & Co. KG (DE) 2016-12-27 US disclosed
US-9018206-B2 Carboxamide compounds and their use as calpain inhibitors AbbVie Deutschland GmbH & Co. KG (DE) 2015-04-28 US disclosed
US-20150099786-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS AbbVie Deutschland GmbH & Co. KG (DE) 2015-04-09 US disclosed
US-20130150367-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS ABBOTT LABORATORIES (US) 2013-06-13 US disclosed
US-8283363-B2 Carboxamide compounds and their use as calpain inhibitors ABBOTT LABORATORIES (US) 2012-10-09 US disclosed
US-8236798-B2 Carboxamide compounds and their use as calpain inhibitors ABBOTT GMBH & CO. KG (DE) 2012-08-07 US disclosed
US-20110086879-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS ABBOTT GMBH & CO. KG (DE) 2011-04-14 US disclosed
US-20100286146-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS ABBOTT GMBH & CO. KG (DE) 2010-11-11 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 (11 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-10934261-B2 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 CAPN1 3/4885ITGB1 3429/4885ITGA4 3989/4885
US-20100286146-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS CAPN1, CAPN2, CAPNS1 CAPN1 1/4885ITGB1 4712/4885ITGA4 4800/4885
US-10894776-B2 CAPNS1, CAPN9, CAPN2 CAPN1 4/4885ITGB1 2849/4885ITGA4 3456/4885
US-20130150367-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS CAPN1, CAPN2, CAPNS1 CAPN1 1/4885ITGB1 4712/4885ITGA4 4800/4885
US-20230190701-A1 Compounds for Treating Tauopathies and Restless Leg Syndrome and Methods of Using and Screening for Same PTPRR, PTPRS, PPP6C CAPN1 2615/4885ITGB1 4812/4885ITGA4 4824/4885
US-20220031653-A1 Compounds for Treating Tauopathies and Restless Leg Syndrome and Methods of Using and Screening for Same PTPRR, PTPRS, PPP6C CAPN1 2615/4885ITGB1 4812/4885ITGA4 4824/4885
US-20210113560-A1 METHOD OF TREATING FIBROTIC DISEASE CAPN9, CAPNS1, CAPN1 CAPN1 3/4885ITGB1 921/4885ITGA4 1952/4885
US-20110086879-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS CAPN1, CAPN2, CAPNS1 CAPN1 1/4885ITGB1 4712/4885ITGA4 4800/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 CAPN1 3/4885ITGB1 3429/4885ITGA4 3989/4885
US-20220324814-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 CAPN1 3/4885ITGB1 3429/4885ITGA4 3989/4885
US-20150099786-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS CAPN1, CAPN2, CAPNS1 CAPN1 1/4885ITGB1 4712/4885ITGA4 4800/4885

“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.