SCHEMBL7465668

SCHEMBL7465668

CC(C)[C@H](NC(=O)O)C(=O)C(Cl)Cl

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
PLA2G2A P14555 1/20 0.30
PLA2G5 P39877 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
SCHEMBL7465674 1.00 LMNA (0.33) LMNASMN1; SMN2ALDH1A1TSHRCYP2D6
SCHEMBL1496401 0.83 ALDH1A1 (0.34) LMNASMN1; SMN2ALDH1A1CYP2D6CYP2C19
SCHEMBL13049755 0.83 ALDH1A1 (0.34) LMNASMN1; SMN2ALDH1A1CYP2D6CYP2C19
SCHEMBL23201575 0.76 SMN1; SMN2 (0.33) LMNASMN1; SMN2ALDH1A1TSHRCYP2D6
SCHEMBL7458559 0.76 LMNA (0.36) LMNACYP2D6CYP2C19
SCHEMBL7458566 0.76 LMNA (0.36) LMNACYP2D6CYP2C19
SCHEMBL15526954 0.76 SMN1; SMN2 (0.33) LMNASMN1; SMN2ALDH1A1TSHRCYP2D6
SCHEMBL14389451 0.75 SMN1; SMN2 (0.48) LMNASMN1; SMN2ALDH1A1TSHRGAA
SCHEMBL8752641 0.75 SMN1; SMN2 (0.48) LMNASMN1; SMN2ALDH1A1TSHRGAA
SCHEMBL9717667 0.75 SMN1; SMN2 (0.48) LMNASMN1; SMN2ALDH1A1TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0930292-B1 PROCESS FOR PREPARING BETA-AMINO-ALPHA-HYDROXY ACID DERIVATIVES KANEKA CORP (JP) 2002-10-16 EP disclosed
US-6087530-A Process for preparing β-amino-α-hydroxy acid derivatives KANEKA CORPORATION (JP) 2000-07-11 US disclosed
EP-0930292-A1 PROCESS FOR PREPARING $g(b)-AMINO-$g(a)-HYDROXY ACID DERIVATIVES KANEKA CORPORATION (JP) 1999-07-21 EP disclosed