SCHEMBL10487540

SCHEMBL10487540

C[C@H](NC(=O)OCc1ccccc1)C(=O)N(CC(=O)O)Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.63
LMNA P02545 1/20 0.63
KMT2A Q03164 1/20 0.63
CTSK P43235 7/20 0.59
CTSL P07711 4/20 0.59
CTSB P07858 4/20 0.59
CTSS P25774 4/20 0.59
ATM Q13315 1/20 0.49
ELANE P08246 2/20 0.46
PRTN3 P24158 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CTRB1 P17538 2/20 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
SCHEMBL10487768 0.94 MEN1 (0.60) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL7334769 0.89 CTSL (0.61) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL18359408 0.88 MEN1 (0.58) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL10487573 0.88 MEN1 (0.58) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL20323002 0.85 MEN1 (0.69) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL10910111 0.84 CTSS (0.52) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL10658290 0.82 CTSK (0.59) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL6782182 0.81 CTSK (0.70) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL5192015 0.81 CTSK (0.70) MEN1LMNAKMT2ACTSKCTSL
SCHEMBL6311475 0.81 CTSK (0.70) MEN1LMNAKMT2ACTSKCTSL

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
US-4820729-A N-substituted-amido-amino acids RORER PHARMACEUTICAL CORPORATION (US) 1989-04-11 US disclosed