SCHEMBL29527180

SCHEMBL29527180

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 7/20 0.58
▸ OPRM1 P35372 6/20 0.58
▸ MME P08473 3/20 0.48
▸ FOLH1 Q04609 1/20 0.47
▸ OPRK1 P41145 1/20 0.47
▸ CHRND Q07001 6/20 0.47
▸ CHRNA1 P02708 2/20 0.47
▸ CHRNG P07510 2/20 0.47
▸ CHRNB1 P11230 2/20 0.47
▸ ACE P12821 2/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ CPA1 P15085 1/20 0.46
▸ ACE2 Q9BYF1 1/20 0.46
▸ GRIA1 P42261 1/20 0.46

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
SCHEMBL29402842 0.95 OPRD1 (0.64) OPRD1OPRM1MMEOPRK1CHRND
SCHEMBL30582928 0.91 OPRD1 (0.49) OPRD1OPRM1MMEFOLH1OPRK1
SCHEMBL31074731 0.91 OPRD1 (0.49) OPRD1OPRM1MMEFOLH1OPRK1
SCHEMBL29658166 0.90 MME (0.60) OPRD1OPRM1MME
SCHEMBL30139031 0.88 ACE (0.56) OPRD1OPRM1MMECHRNDCHRNA1
SCHEMBL29350940 0.86 OPRD1 (0.55) OPRD1OPRM1MMEFOLH1OPRK1
SCHEMBL31721987 0.85 OPRM1 (0.58) OPRD1OPRM1MMEFOLH1ACE
SCHEMBL29517104 0.85 ACE (0.55) MMEFOLH1ACECPA1ACE2
SCHEMBL31257978 0.85 OPRD1 (0.57) OPRD1OPRM1MMEOPRK1ACE
SCHEMBL31415936 0.85 OPRM1 (0.51) OPRD1OPRM1MMEOPRK1ACE

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-114807105-A Lyase with strong temperature tolerance, preparation method and application 吉林大学 2022-07-29 — — CN disclosed
CN-114269774-A Appetite suppressant compounds IP2IPO创新有限公司 2022-04-01 — — CN disclosed
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