SCHEMBL29616244

SCHEMBL29616244

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 3/20 0.66
▸ OPRM1 P35372 2/20 0.66
▸ MAGI3 Q5TCQ9 1/20 0.52
▸ EDNRA P25101 1/20 0.51
▸ CCKAR P32238 2/20 0.49
▸ CCKBR P32239 2/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ TACR1 P25103 1/20 0.49
▸ ACE P12821 1/20 0.48
▸ LTA4H P09960 1/20 0.48
▸ KISS1R Q969F8 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
SCHEMBL30050981 0.91 OPRM1 (0.57) OPRD1OPRM1MAGI3EDNRAKMT2A
SCHEMBL30051121 0.90 OPRM1 (0.56) OPRD1OPRM1KMT2AL3MBTL1ACE
SCHEMBL30051161 0.88 OPRM1 (0.57) OPRD1OPRM1MAGI3EDNRAKMT2A
SCHEMBL31461905 0.88 OPRM1 (0.52) OPRD1OPRM1MAGI3EDNRACCKAR
SCHEMBL30051740 0.87 ACE (0.59) MAGI3EDNRAKMT2AL3MBTL1ACE
SCHEMBL30052858 0.87 OPRM1 (0.69) OPRD1OPRM1KMT2AACELTA4H
SCHEMBL31045764 0.86 MAGI3 (0.54) OPRD1OPRM1MAGI3EDNRACCKAR
SCHEMBL30503003 0.85 OPRD1 (0.68) OPRD1OPRM1CCKARCCKBRLTA4H
SCHEMBL30051105 0.85 ACE (0.56) MAGI3EDNRAKMT2AL3MBTL1ACE
SCHEMBL31045811 0.85 MAGI3 (0.57) OPRD1OPRM1MAGI3EDNRAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240287128-A1 EXTREMELY FAST SOLID PHASE SYNTHESIS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2024-08-29 — — US disclosed
EP-4247830-A1 EXTREMELY FAST SOLID PHASE SYNTHESIS Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2023-09-27 — — EP disclosed
CN-116670148-A Extremely fast solid phase synthesis 耶路撒冷希伯来大学伊森姆研究发展有限公司 2023-08-29 — — CN disclosed
WO-2022107134-A1 EXTREMELY FAST SOLID PHASE SYNTHESIS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2022-05-27 — — WO disclosed
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