SCHEMBL31456236

SCHEMBL31456236

CC(C)CCOC[C@H](NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 9/20 0.56
CTSL P07711 6/20 0.53
CTSS P25774 3/20 0.53
CTSB P07858 3/20 0.53
PPARA Q07869 1/20 0.53
FOLH1 Q04609 1/20 0.51
CAPN1 P07384 2/20 0.49
CAPN2 P17655 1/20 0.49

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
SCHEMBL31456215 1.00 CTSK (0.56) CTSKCTSLCTSSCTSBPPARA
SCHEMBL22108924 0.89 CTSK (0.50) CTSKCTSLCTSSCTSBPPARA
SCHEMBL22091979 0.89 CTSK (0.50) CTSKCTSLCTSSCTSBPPARA
SCHEMBL22091978 0.89 CTSK (0.50) CTSKCTSLCTSSCTSBPPARA
SCHEMBL31456227 0.89 CTSK (0.48) CTSKCTSLCTSSCTSB
SCHEMBL31456194 0.88 CTSK (0.60) CTSKCTSLCTSSCTSBPPARA
SCHEMBL21837541 0.88 PPARA (0.58) CTSKCTSLCTSSCTSBPPARA
SCHEMBL21837546 0.88 PPARA (0.58) CTSKCTSLCTSSCTSBPPARA
SCHEMBL31456302 0.87 PPARA (0.55) CTSKCTSLCTSSCTSBPPARA
SCHEMBL19089075 0.86 CTSL (0.50) CTSKCTSLCTSSCTSBPPARA

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-4541787-A1 METHOD FOR PRODUCING O-SUBSTITUTED SERINE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-04-23 EP disclosed
CN-119630640-A Process for the production of O-substituted serine derivatives 中外制药株式会社 2025-03-14 CN disclosed