SCHEMBL29493717

SCHEMBL29493717

C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NTSR2 O95665 1/20 0.42
▸ NTSR1 P30989 1/20 0.42
▸ F2 P00734 3/20 0.42
▸ APLNR P35414 2/20 0.42
▸ NTMT1 Q9BV86 2/20 0.41
▸ FAP Q12884 1/20 0.41
▸ ACE P12821 2/20 0.41
▸ CPB2 Q96IY4 3/20 0.40
▸ OPRD1 P41143 3/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ ITGB3 P05106 1/20 0.39
▸ ITGA2B P08514 1/20 0.39

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
SCHEMBL29904095 0.90 APLNR (0.48) NTSR2NTSR1APLNRFAPCPB2
SCHEMBL31670626 0.88 APLNR (0.45) NTSR2NTSR1F2APLNRNTMT1
SCHEMBL31670640 0.85 XIAP (0.38) F2APLNRFAPACE
SCHEMBL29824941 0.85 NTMT1 (0.45) NTSR2NTSR1F2APLNRNTMT1
SCHEMBL31670649 0.85 APLNR (0.42) APLNROPRM1
SCHEMBL29421959 0.85 APLNR (0.51) NTSR2NTSR1F2APLNROPRD1
SCHEMBL30493464 0.84 APLNR (0.42) APLNRFAPOPRD1OPRM1
SCHEMBL29904042 0.84 APLNR (0.42) NTSR1F2APLNROPRD1OPRM1
SCHEMBL29421993 0.84 F2 (0.52) F2NTMT1ACECPB2OPRM1
SCHEMBL31254508 0.84 F2 (0.61) F2OPRD1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4121130-A1 LIQUID EMBOLICS MicroVention, Inc. (US) 2023-01-25 — — EP disclosed
WO-2022124847-A1 COMPOSITION FOR REGENERATING TISSUE, AND METHOD FOR PRODUCING SAME 주식회사 로킷헬스케어 2022-06-16 — — WO disclosed
US-20220080083-A1 METHOD FOR FABRICATING MULTI-LAYERED CELL SHEET AND MULTI-LAYERED SHEET FABRICATED BY USING THE SAME Rokit Healthcare Inc. (KR) 2022-03-17 — — US disclosed
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