SCHEMBL5118660

SCHEMBL5118660

COC(=O)C[C@H](NC(=O)c1ccc(C)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.49
CA1 P00915 4/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HPGD P15428 2/20 0.46
LMNA P02545 2/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL5210394 1.00 CA2 (0.49) CA2CA1MEN1KMT2ASMN1; SMN2
SCHEMBL26823872 0.88 TAS1R3 (0.50) MEN1KMT2ASMN1; SMN2HPGDALDH1A1
SCHEMBL820939 0.88 SMN1; SMN2 (0.49) MEN1KMT2ASMN1; SMN2HPGDLMNA
SCHEMBL8211973 0.88 MEN1 (0.48) CA2CA1MEN1KMT2AHPGD
SCHEMBL6504398 0.88 MEN1 (0.48) CA2CA1MEN1KMT2AHPGD
SCHEMBL6507992 0.87 CA2 (0.51) CA2CA1HPGDLMNAALDH1A1
SCHEMBL5222859 0.87 KMT2A (0.51) CA2CA1MEN1KMT2ASMN1; SMN2
SCHEMBL29277520 0.84 CA2 (0.62) CA2CA1MEN1KMT2ASMN1; SMN2
SCHEMBL12985394 0.83 SMN1; SMN2 (0.50) CA2CA1MEN1KMT2ASMN1; SMN2
SCHEMBL12985393 0.83 SMN1; SMN2 (0.50) CA2CA1MEN1KMT2ASMN1; SMN2

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
US-20080026067-A1 Method for Increasing Specific Surface Area of Slightly Soluble Drug ONO PHARMACEUTICAL CO., LTD. (JP) 2008-01-31 US disclosed
EP-1741704-A1 METHOD FOR INCREASING SPECIFIC SURFACE AREA OF SLIGHTLY SOLUBLE DRUG ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-10 EP disclosed