SCHEMBL13370243

SCHEMBL13370243

Cc1ccc(C(=O)N[C@H](CO)C(=O)O)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.65
CA1 P00915 7/20 0.65
CA12 O43570 1/20 0.58
CA9 Q16790 1/20 0.58
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HPGD P15428 2/20 0.51
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
LMNA P02545 2/20 0.49
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.49
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL12982952 1.00 CA2 (0.65) CA2CA1CA12CA9MEN1
SCHEMBL12982953 1.00 CA2 (0.65) CA2CA1CA12CA9MEN1
SCHEMBL18803702 0.88 MEN1 (0.56) CA2CA1CA12CA9MEN1
SCHEMBL10659467 0.86 MEN1 (0.54) CA2CA1CA12CA9MEN1
SCHEMBL4682874 0.85 MEN1 (0.53) CA2CA1MEN1KMT2ASMN1; SMN2
SCHEMBL5867364 0.85 CA2 (0.64) CA2CA1CA12CA9MEN1
SCHEMBL4682872 0.85 MEN1 (0.53) CA2CA1MEN1KMT2ASMN1; SMN2
SCHEMBL10658899 0.84 CA2 (0.51) CA2CA1CA12CA9MEN1
SCHEMBL10658891 0.84 CA2 (0.51) CA2CA1CA12CA9MEN1
SCHEMBL2792747 0.84 CA2 (0.66) CA2CA1CA12CA9

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-2514402-B1 PREVENTING OR AMELIORATING AGENT FOR PIGMENTATION POLA CHEM IND INC (JP) 2016-08-31 EP disclosed
EP-2514402-A1 PROPHYLACTIC OR AMELIORATING AGENT FO PIGMENTATION Pola Chemical Industries Inc. (JP) 2012-10-24 EP disclosed