SCHEMBL29929403

SCHEMBL29929403

COc1ccc(C(OCC2CC(OP(OCCC#N)N(C(C)C)C(C)C)CN2C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)OCC2c3ccccc3-c3ccccc32)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 1/20 0.32
▸ TACR1 P25103 1/20 0.32
▸ BMP1 P13497 1/20 0.31
▸ PTPN1 P18031 1/20 0.30

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
SCHEMBL30924967 0.88 SLC6A1 (0.32) —
SCHEMBL30924968 0.83 MDM2 (0.39) MDM2TACR1PTPN1
SCHEMBL27241030 0.82 SLC6A11 (0.34) TACR1
SCHEMBL27241008 0.82 SLC6A11 (0.34) TACR1
SCHEMBL21662396 0.81 SLC6A11 (0.36) —
SCHEMBL2997021 0.80 SLC6A11 (0.37) —
SCHEMBL29929002 0.78 MDM2 (0.32) MDM2BMP1
SCHEMBL11992573 0.76 SLC6A11 (0.34) —
SCHEMBL16299839 0.76 SLC6A11 (0.35) —
SCHEMBL26302696 0.75 SLC6A11 (0.33) —

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
EP-4298231-A1 METHODS FOR LIGATION OF (POLY)PEPTIDES AND OLIGONUCLEOTIDES Nanyang Technological University (SG) 2024-01-03 — — EP disclosed
WO-2022182294-A1 METHODS FOR LIGATION OF (POLY)PEPTIDES AND OLIGONUCLEOTIDES NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2022-09-01 — — WO disclosed
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