SCHEMBL9862867

SCHEMBL9862867

C[C@H](OC(=O)C(C)(C)C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.41
TP53 P04637 1/20 0.35
ELANE P08246 3/20 0.32
CYP1A2 P05177 1/20 0.31
GAA P10253 1/20 0.31
CYP2C9 P11712 1/20 0.31
PKM P14618 1/20 0.31
CYP2C19 P33261 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PTGS1 P23219 1/20 0.31
TSHR P16473 1/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 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
SCHEMBL4297712 1.00 PRKCA (0.41) PRKCATP53ELANECYP1A2GAA
SCHEMBL4297713 1.00 PRKCA (0.41) PRKCATP53ELANECYP1A2GAA
SCHEMBL8947297 0.83 ALDH1A1 (0.39) PRKCATP53CYP1A2GAACYP2C9
SCHEMBL15751826 0.79 TP53 (0.31) TP53ALDH1A1TSHR
SCHEMBL8617231 0.79 MMP1 (0.35) PRKCATP53CYP2C19TSHRMMP1
SCHEMBL3757699 0.78 PRKCA (0.44) PRKCAELANE
SCHEMBL13050301 0.78 PRKCA (0.39) PRKCAELANE
SCHEMBL19812415 0.78 TP53 (0.33) TP53CYP1A2GAACYP2C9PKM
SCHEMBL9862913 0.78 PRKCA (0.39) PRKCAELANE
SCHEMBL7113909 0.78 TP53 (0.33) TP53CYP1A2GAACYP2C9PKM

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-0299484-B1 PROCESS FOR THE PREPARATION OF INTERMEDIATES FOR THE SYNTHESIS OF FOSFOMYCIN ZAMBON GROUP S.p.A. (IT) 1991-10-09 EP disclosed
US-4937367-A Process for the preparation of intermediates for the synthesis of fosfomycin ZAMBON GROUP S.P.A. (IT) 1990-06-26 US disclosed
EP-0299484-A1 Process for the preparation of intermediates for the synthesis of fosfomycin ZAMBON GROUP S.p.A. (IT) 1989-01-18 EP disclosed