SCHEMBL3089699

SCHEMBL3089699

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CXCR4 P61073 8/20 0.57
▸ CTSL P07711 3/20 0.53
▸ CTSS P25774 3/20 0.53
▸ CTSK P43235 3/20 0.53
▸ CTSH P09668 1/20 0.53
▸ NPY1R P25929 1/20 0.51
▸ NPY2R P49146 1/20 0.51
▸ NPY4R P50391 1/20 0.51
▸ NPY5R Q15761 1/20 0.51
▸ TACR2 P21452 3/20 0.50
▸ TACR1 P25103 1/20 0.50
▸ GCGR P47871 1/20 0.50
▸ GIPR P48546 1/20 0.50
▸ KISS1R Q969F8 1/20 0.50
▸ CTNNB1 P35222 1/20 0.49
▸ CXCL8 P10145 1/20 0.49

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
SCHEMBL3089689 1.00 CXCR4 (0.57) CXCR4CTSLCTSSCTSKCTSH
SCHEMBL29463731 0.98 CXCR4 (0.58) CXCR4CTSLCTSSCTSKCTSH
SCHEMBL8937035 0.93 CXCR4 (0.56) CXCR4CTSLCTSSCTSKCTSH
SCHEMBL29627461 0.91 TACR1 (0.60) CXCR4TACR2TACR1
SCHEMBL9740766 0.91 CXCR4 (0.54) CXCR4CTSLCTSSCTSKCTSH
SCHEMBL9740739 0.91 CXCR4 (0.54) CXCR4CTSLCTSSCTSKCTSH
SCHEMBL8073467 0.90 TACR1 (0.54) CXCR4CTSLCTSSCTSKCTSH
SCHEMBL24120770 0.89 CXCR4 (0.55) CXCR4CTSLCTSSCTSKCTSH
SCHEMBL14583957 0.88 TACR2 (0.52) CXCR4TACR2TACR1KISS1RCXCL8
SCHEMBL31668913 0.86 C5AR1 (0.61) CXCR4NPY1RNPY2RNPY4RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5840691-A ADMINISTERING TO SUPPRESS INFLAMMATION, INHIBIT INFILTRATION OF LEUKOCYTES INTO TISSUE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 1998-11-24 — — US claimed
US-5591719-A TREATMENT OF ARTHRITIS, BLOCKING LEUKOCYTE ADHESION TO EPITHELIAL CELLS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1997-01-07 — — US claimed
EP-0673384-A4 POLYPEPTIDES USEFUL FOR TREATING INFLAMMATORY DISORDERS. UNIV MINNESOTA (US) 1996-10-09 — — EP claimed
EP-0673384-A1 POLYPEPTIDES USEFUL FOR TREATING INFLAMMATORY DISORDERS THE REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1995-09-27 — — EP claimed
WO-1994013692-A1 POLYPEPTIDES USEFUL FOR TREATING INFLAMMATORY DISORDERS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1994-06-23 — — WO claimed
US-5294551-A Heparin binders; adhesion promoters; oligopeptides REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1994-03-15 — — US claimed
US-5171271-A Polypeptides with fibronectin activity REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1992-12-15 — — US claimed
US-5019646-A Polypeptides with fibronectin activity REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1991-05-28 — — US claimed
EP-0366728-A1 POLYPEPTIDES WITH FIBRONECTIN ACTIVITY. UNIV MINNESOTA (US) 1990-05-09 — — EP claimed
WO-1989001942-A1 POLYPEPTIDES WITH FIBRONECTIN ACTIVITY REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1989-03-09 — — WO claimed
US-12013392-B2 Global proteomic screening of random bead arrays using mass spectrometry imaging AMBERGEN, INC. (US) 2024-06-18 — — US disclosed
US-20240069013-A1 GLOBAL PROTEOMIC SCREENING OF RANDOM BEAD ARRAYS USING MASS SPECTROMETRY IMAGING AMBERGEN, INC. 2024-02-29 — — US disclosed
US-11846634-B2 Global proteomic screening of random bead arrays using mass spectrometry imaging AMBERGEN, INC. (US) 2023-12-19 — — US disclosed
CN-111233714-B Preparation method of MAPS polypeptide 滨海吉尔多肽有限公司 2022-04-08 — — CN disclosed
CN-111206017-B Serum-free culture medium for stem cells and application thereof 浙江大学 2022-02-18 — — CN disclosed
US-5744515-A CONTACTING SURFACE OF POROUS BIOMATERIAL HAVING CHANNELS FOR CAPILLARY GROWTH WITH AN ADHESION MOLECULE SUCH AS, FIBRONECTIN, COLLAGEN AND ACTIVE PEPTIDE DOMAINS, BEARING PHOTOACTIVE GROUPS, ACTIVATING TO IMMOBILIZE ADHESION MOLECULE BSI CORPORATION (US) 1998-04-28 — — US disclosed
US-5294551-A Heparin binders; adhesion promoters; oligopeptides REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1994-03-15 — — US disclosed
EP-0366728-B1 POLYPEPTIDES WITH FIBRONECTIN ACTIVITY THE REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1993-04-07 — — EP disclosed
EP-0366728-A1 POLYPEPTIDES WITH FIBRONECTIN ACTIVITY. UNIV MINNESOTA (US) 1990-05-09 — — EP disclosed
WO-1989001942-A1 POLYPEPTIDES WITH FIBRONECTIN ACTIVITY REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1989-03-09 — — WO disclosed
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