SCHEMBL7310753

SCHEMBL7310753

O=C(N[C@@H](Cc1ccc(C(=O)O)cc1)C(=O)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.63
TYR P14679 2/20 0.58
CTSL P07711 2/20 0.58
CTSB P07858 2/20 0.58
CTSS P25774 2/20 0.58
CTSK P43235 2/20 0.58
ALDH1A1 P00352 1/20 0.57
ALOX15 P16050 1/20 0.57
CTRB1 P17538 2/20 0.56
ACE P12821 1/20 0.55
PPARG P37231 1/20 0.54
PPARA Q07869 1/20 0.54
ITGB3 P05106 2/20 0.54
ITGA2B P08514 2/20 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
SCHEMBL29221343 1.00 TACR1 (0.63) TACR1TYRCTSLCTSBCTSS
SCHEMBL7282201 0.92 ALDH1A1 (0.65) TACR1CTSLCTSBCTSSCTSK
SCHEMBL14793780 0.92 TACR1 (0.63) TACR1CTSLCTSBCTSSCTSK
SCHEMBL7289712 0.92 TACR1 (0.63) TACR1CTSLCTSBCTSSCTSK
SCHEMBL15080871 0.92 TACR1 (0.68) TACR1TYRCTSLCTSBCTSS
SCHEMBL30343691 0.89 CTSL (0.64) TACR1TYRCTSLCTSBCTSS
SCHEMBL3065366 0.89 CTSL (0.64) TACR1TYRCTSLCTSBCTSS
SCHEMBL29634828 0.87 TACR1 (0.60) TACR1TYRCTSLCTSBCTSS
SCHEMBL22636176 0.87 TACR1 (0.60) TACR1TYRCTSLCTSBCTSS
SCHEMBL22636177 0.87 TACR1 (0.60) TACR1TYRCTSLCTSBCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4526323-A1 MACROCYCLIC IMMUNOMODULATORS Bristol-Myers Squibb Company (US) 2025-03-26 EP disclosed
EP-4499667-A1 MACROCYCLIC IMMUNOMODULATORS Bristol-Myers Squibb Company (US) 2025-02-05 EP disclosed
CN-119013287-A Macrocyclic immunomodulators 百时美施贵宝公司 2024-11-22 CN disclosed
EP-4441069-A1 MACROCYCLIC IMMUNOMODULATORS Bristol-Myers Squibb Company (US) 2024-10-09 EP disclosed
CN-118613490-A Macrocyclic immunomodulators 百时美施贵宝公司 2024-09-06 CN disclosed
CN-118076623-A Macrocyclic immunomodulators 百时美施贵宝公司 2024-05-24 CN disclosed
CN-117940445-A Macrocyclic immunomodulators 百时美施贵宝公司 2024-04-26 CN disclosed
WO-2024059472-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2024-03-21 WO disclosed
WO-2023225661-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-11-23 WO disclosed
WO-2023192873-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-10-05 WO disclosed
WO-2023102507-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-08 WO disclosed
WO-2023102507-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-08 WO disclosed
WO-2023004240-A1 MACROCYLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-01-26 WO disclosed
US-5556941-A ANTICOAGULANTS, THROMBIN INHIBITORS BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1996-09-17 US disclosed
EP-0558961-A2 Glycopeptide derivatives, process for their manufacture and pharmaceutical compositions comprising them BEHRINGWERKE Aktiengesellschaft (DE) 1993-09-08 EP disclosed