SCHEMBL1556430

SCHEMBL1556430

CC(C)(C)C(=O)CN1C(=O)[C@H](NC(=O)Nc2cccc(C(=O)O)c2)CN(C2CCCCC2)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 17/20 0.54
CCKAR P32238 10/20 0.54

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
SCHEMBL29645924 1.00 CCKBR (0.54) CCKBRCCKAR
SCHEMBL6177344 1.00 CCKBR (0.54) CCKBRCCKAR
SCHEMBL1556431 1.00 CCKBR (0.54) CCKBRCCKAR
SCHEMBL19949394 1.00 CCKBR (0.54) CCKBRCCKAR
SCHEMBL6177296 1.00 CCKBR (0.54) CCKBRCCKAR
Water SCHEMBL1394819 0.99 CCKBR (0.53) CCKBRCCKAR
Water SCHEMBL29806115 0.99 CCKBR (0.53) CCKBRCCKAR
Water SCHEMBL1394812 0.99 CCKBR (0.53) CCKBRCCKAR
SCHEMBL6177951 0.99 CCKBR (0.53) CCKBRCCKAR
SCHEMBL6177958 0.99 CCKBR (0.53) CCKBRCCKAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180318314-A1 ANTITUMOR AGENT ZERIA PHARMACEUTICAL CO., LTD. (JP) 2018-11-08 US claimed
US-20170151256-A1 ANTITUMOR AGENT ZERIA PHARMACEUTICAL CO., LTD. (JP) 2017-06-01 US claimed
EP-2305654-B1 THERAPEUTIC AGENT FOR CANCER PAIN ZERIA PHARM CO LTD (JP) 2015-10-14 EP claimed
US-20150038495-A1 THERAPEUTIC AGENT FOR PAIN ZERIA PHARMACEUTICAL CO., LTD. (JP) 2015-02-05 US claimed
EP-2305654-A1 THERAPEUTIC AGENT FOR PAIN Zeria Pharmaceutical Co., Ltd. (JP) 2011-04-06 EP claimed
US-20110059956-A1 THERAPEUTIC AGENT FOR PAIN ZERIA PHARMACEUTICAL CO., LTD. (JP) 2011-03-10 US claimed
US-20100143366-A1 ANTITUMOR AGENT ZERIA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 US claimed
US-20100086553-A1 ANTITUMOR AGENT ZERIA PHARMACEUTICAL CO., LTD. (JP) 2010-04-08 US claimed
EP-1839662-B1 ANTITUMOR AGENT ZERIA PHARM CO LTD (JP) 2010-03-24 EP claimed
US-20080161293-A1 Antitumor Agent ZERIA PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 US claimed
EP-1839662-A1 ANTITUMOR AGENT Zeria Pharmaceutical Co., Ltd. (JP) 2007-10-03 EP claimed
EP-1234818-B1 CALCIUM SALTS OF 1,5-BENZODIAZEPINE DERIVATIVES, PROCESS FOR PRODUCING THE SALTS AND DRUGS CONTAINING THE SAME ZERIA PHARM CO LTD (JP) 2004-09-08 EP claimed
US-6747022-B2 TREATING DIGESTIVE TRACT DISEASE RESULTING FROM EXCESSIVE SECRETION OF GASTRIC ACID ZERIA PHARMACEUTICAL CO., LTD. (JP) 2004-06-08 US claimed
US-20030096809-A1 Calcium salts of 1,5-benzodiazepine derivatives, process for producing the salts and drugs containing the same ZERIA PHARMACEUTICAL CO., LTD. (JP) 2003-05-22 US claimed
EP-1234818-A1 CALCIUM SALTS OF 1,5-BENZODIAZEPINE DERIVATIVES, PROCESS FOR PRODUCING THE SALTS AND DRUGS CONTAINING THE SAME Zeria Pharmaceutical Co., Ltd. (JP) 2002-08-28 EP claimed
US-11344623-B2 Cholecystokinin B receptor targeting for imaging and therapy PURDUE RESEARCH FOUNDATION (US) 2022-05-31 US disclosed
US-20200384114-A1 CHOLECYSTOKININ B RECEPTOR TARGETING FOR IMAGING AND THERAPY PURDUE RESEARCH FOUNDATION 2020-12-10 US disclosed
EP-1234818-A1 CALCIUM SALTS OF 1,5-BENZODIAZEPINE DERIVATIVES, PROCESS FOR PRODUCING THE SALTS AND DRUGS CONTAINING THE SAME Zeria Pharmaceutical Co., Ltd. (JP) 2002-08-28 EP disclosed
US-6239131-B1 WHICH HAVE GASTRIN AND/OR CCK-B (CHOLECYSTOKININ-B) RECEPTOR ANTAGONISM, USEFUL AS REMEDIES FOR GASTRIC ULCER AND GASTROINTESTINAL MOVEMENT DISORDER. ZERIA PHARMACEUTICAL CO., LTD. (JP) 2001-05-29 US disclosed
EP-0945445-A1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 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 (10 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-11344623-B2 Cholecystokinin B receptor targeting for imaging and therapy CCKBR, CCKAR, GRPR CCKBR 1/4885CCKAR 2/4885
US-20110059956-A1 THERAPEUTIC AGENT FOR PAIN OPRK1, OPRD1, OPRL1 CCKBR 466/4885CCKAR 85/4885
US-20100086553-A1 ANTITUMOR AGENT MEN1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, GABRA1 CCKBR 135/4885CCKAR 90/4885
US-20180318314-A1 ANTITUMOR AGENT MEN1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, GABRA1 CCKBR 135/4885CCKAR 90/4885
US-20080161293-A1 Antitumor Agent MEN1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, GABRA1 CCKBR 135/4885CCKAR 90/4885
US-20150038495-A1 THERAPEUTIC AGENT FOR PAIN OPRK1, OPRD1, OPRL1 CCKBR 466/4885CCKAR 85/4885
US-20200384114-A1 CHOLECYSTOKININ B RECEPTOR TARGETING FOR IMAGING AND THERAPY CCKBR, CCKAR, GRPR CCKBR 1/4885CCKAR 2/4885
US-20030096809-A1 Calcium salts of 1,5-benzodiazepine derivatives, process for producing the salts and drugs containing the same CCKBR, CCKAR, GABRB1 CCKBR 1/4885CCKAR 2/4885
US-20170151256-A1 ANTITUMOR AGENT MEN1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, GABRA1 CCKBR 135/4885CCKAR 90/4885
US-20100143366-A1 ANTITUMOR AGENT MEN1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, GABRA1 CCKBR 135/4885CCKAR 90/4885

“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.