SCHEMBL30845899

SCHEMBL30845899

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

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.53
▸ FDFT1 P37268 2/20 0.52
▸ MDM4 O15151 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ MDM2 Q00987 4/20 0.48
▸ KMT2A Q03164 1/20 0.47
▸ PTPN1 P18031 2/20 0.47

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
SCHEMBL30931748 0.94 FDFT1 (0.56) CASP3FDFT1MDM4TP53MDM2
SCHEMBL38651107 0.91 PTPN1 (0.54) CASP3FDFT1MDM4TP53MDM2
SCHEMBL29785164 0.90 FDFT1 (0.59) CASP3FDFT1MDM4TP53MDM2
SCHEMBL800035 0.90 FDFT1 (0.57) CASP3FDFT1MDM4TP53MDM2
SCHEMBL29768618 0.90 FDFT1 (0.57) CASP3FDFT1MDM4TP53MDM2
SCHEMBL4600701 0.90 FDFT1 (0.57) CASP3FDFT1MDM4TP53MDM2
SCHEMBL29762010 0.90 FDFT1 (0.57) CASP3FDFT1MDM4TP53MDM2
SCHEMBL800305 0.90 FDFT1 (0.57) CASP3FDFT1MDM4TP53MDM2
SCHEMBL29362132 0.90 FDFT1 (0.57) CASP3FDFT1MDM4TP53MDM2
SCHEMBL29400804 0.90 FDFT1 (0.57) CASP3FDFT1MDM4TP53MDM2

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-112638934-B Solution phase Path for WNT hexapeptide 温特研究公司 2024-06-11 — — CN disclosed
CN-113646324-B Linear solution phase pathway for WNT hexapeptide 温特研究公司 2024-03-29 — — CN disclosed
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