SCHEMBL9504877

SCHEMBL9504877

O=C(O)[C@@H](CO)Nc1cccc(O)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
PKLR P30613 2/20 0.38
CA2 P00918 7/20 0.38
CA1 P00915 6/20 0.38
PPARG P37231 1/20 0.36
MME P08473 1/20 0.36
ALOX5 P09917 1/20 0.36
TERT O14746 1/20 0.36
ADAMTS4 O75173 1/20 0.35
EGFR P00533 1/20 0.35
FYN P06241 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35

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
SCHEMBL421667 1.00 MEN1 (0.39) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL2159580 1.00 MEN1 (0.39) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL6834106 0.83 PPARG (0.51) MEN1KMT2APPARGMME
SCHEMBL21359031 0.79 CA2 (0.37) ALDH1A1PKLRCA2CA1MME
SCHEMBL1627872 0.76 LMNA (0.41) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL12984801 0.76 ALDH1A1 (0.49) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL5323263 0.76 LMNA (0.41) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL407185 0.75 CA2 (0.50) ALDH1A1LMNACA2CA1MME
SCHEMBL6672463 0.75 MEN1 (0.55) MEN1KMT2AGAAALDH1A1MAPT
SCHEMBL407186 0.75 CA2 (0.50) ALDH1A1LMNACA2CA1MME

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-0375554-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE THREO-DIHYDROXYPHENYLSERINE DERIVATIVES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1993-05-05 EP disclosed
EP-0375554-A2 Process for producing optically active threo-dihydroxyphenylserine derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-06-27 EP disclosed