SCHEMBL29722079

SCHEMBL29722079

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 6/20 0.49
▸ MME P08473 1/20 0.49
▸ ECE1 P42892 1/20 0.49
▸ MDM4 O15151 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ REN P00797 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
SCHEMBL29777550 0.92 PTPN1 (0.47) PTPN1MME
SCHEMBL29767979 0.91 CASP3 (0.52) PTPN1ECE1MDM4TP53
SCHEMBL30656185 0.90 CASP3 (0.51) PTPN1REN
SCHEMBL29372762 0.90 PTPN1 (0.50) PTPN1MMEECE1MDM4TP53
SCHEMBL30892068 0.89 PTPN1 (0.49) PTPN1MDM4TP53
SCHEMBL14787143 0.89 MDM4 (0.47) MDM4TP53KMT2A
SCHEMBL31564904 0.89 PTPN1 (0.56) PTPN1REN
SCHEMBL30804341 0.88 MME (0.53) MMEMDM4TP53KMT2A
SCHEMBL14788960 0.88 MDM4 (0.46) PTPN1MDM4TP53KMT2A
SCHEMBL30582698 0.88 CASP3 (0.54) MDM4TP53KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114736271-A Synthesis method of Tirzepatide 杭州诺泰澳赛诺医药技术开发有限公司 2022-07-12 — — CN disclosed
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