SCHEMBL29467321

SCHEMBL29467321

O=C(NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.45
▸ MDM4 O15151 3/20 0.43
▸ TP53 P04637 3/20 0.43
▸ OPRD1 P41143 1/20 0.42
▸ FDFT1 P37268 1/20 0.42
▸ PREP P48147 2/20 0.42
▸ KMT2A Q03164 1/20 0.41
▸ CASP3 P42574 2/20 0.41
▸ MDM2 Q00987 1/20 0.40
▸ FAP Q12884 1/20 0.39
▸ PRCP P42785 1/20 0.39
▸ PIN1 Q13526 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
SCHEMBL30139062 0.97 F2 (0.43) F2MDM4TP53OPRD1FDFT1
SCHEMBL31113348 0.91 PSMB9 (0.46) F2MDM4TP53OPRD1FDFT1
SCHEMBL30139020 0.89 FDFT1 (0.42) F2MDM4TP53OPRD1FDFT1
SCHEMBL31297113 0.88 F2 (0.47) F2FDFT1MDM2FAPPRCP
SCHEMBL29749447 0.88 CTRB1 (0.48) F2MDM4TP53FDFT1KMT2A
SCHEMBL2946630 0.87 FAP (0.40) F2OPRD1FDFT1CASP3FAP
SCHEMBL13743328 0.86 FAP (0.49) OPRD1FAP
SCHEMBL31258873 0.85 OPRD1 (0.49) F2OPRD1PREPKMT2AFAP
SCHEMBL21462327 0.85 OPRD1 (0.49) F2OPRD1PREPKMT2AFAP
SCHEMBL29444020 0.85 OPRD1 (0.49) F2OPRD1PREPKMT2AFAP

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
CN-114315960-B Modified peptide, and cosmetic composition or medicinal composition and application thereof 深圳市维琪医药研发有限公司 2022-10-14 — — CN disclosed
CN-115181173-A Preparation method of Tirzepatide 深圳市健元医药科技有限公司 2022-10-14 — — CN disclosed
CN-114315960-A Modified peptide, and cosmetic composition or medicinal composition and application thereof 深圳市维琪医药研发有限公司 2022-04-12 — — CN disclosed
CN-114269775-A Preparation method of incretin analogue 伊莱利利公司 2022-04-01 — — CN disclosed
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