SCHEMBL29658158

SCHEMBL29658158

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 6/20 0.50
▸ ACE P12821 3/20 0.50
▸ CPA1 P15085 2/20 0.50
▸ ACE2 Q9BYF1 2/20 0.50
▸ OPRM1 P35372 1/20 0.50
▸ OPRD1 P41143 1/20 0.50
▸ CTSB P07858 1/20 0.49
▸ GNPAT O15228 1/20 0.49
▸ MMP2 P08253 1/20 0.49
▸ MMP7 P09237 1/20 0.49
▸ MMP9 P14780 1/20 0.49
▸ MMP12 P39900 1/20 0.49
▸ MMP13 P45452 1/20 0.49
▸ PSMB5 P28074 2/20 0.48
▸ CTSC P53634 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
SCHEMBL27852467 0.94 MME (0.53) MMEACECPA1ACE2MMP2
SCHEMBL27852469 0.94 MME (0.53) MMEACECPA1ACE2MMP2
SCHEMBL30054155 0.93 MME (0.56) MMEACECPA1ACE2OPRM1
SCHEMBL29784904 0.92 BACE1 (0.47) MMEACEOPRM1OPRD1CTSB
SCHEMBL30055181 0.92 MME (0.49) MMEACECPA1ACE2OPRM1
SCHEMBL29658166 0.91 MME (0.60) MMEOPRM1OPRD1CTSBPSMB5
SCHEMBL31257978 0.91 OPRD1 (0.57) MMEACEOPRM1OPRD1
SCHEMBL8068326 0.89 MME (0.61) MMEACECPA1ACE2GNPAT
SCHEMBL8068319 0.89 MME (0.61) MMEACECPA1ACE2GNPAT
SCHEMBL31419815 0.89 KISS1R (0.48) MMEOPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113150146-B IL-4R alpha antibodies and uses thereof 北京凯因科技股份有限公司 2022-07-12 — — CN disclosed
CN-114478789-A anti-PD-L1 and OX40 bispecific antibodies and uses thereof 安徽安科生物工程(集团)股份有限公司 2022-05-13 — — CN disclosed
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