SCHEMBL7383379

SCHEMBL7383379

NC(=O)CC(O)C(O)CC(N)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ALOX15 P16050 2/20 0.39
BLM P54132 2/20 0.39
PMP22 Q01453 2/20 0.39
CYP2C19 P33261 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
GLA P06280 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
THPO P40225 1/20 0.39
RECQL P46063 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL2480041 0.88 USP2 (0.39) LMNAALDH1A1TDP1ALOX15BLM
SCHEMBL28872404 0.82 PGD (0.45) LMNAALDH1A1TDP1ALOX15BLM
SCHEMBL18746010 0.82
SCHEMBL22029868 0.80
SCHEMBL15810294 0.80 ECE1 (0.33) LMNAALDH1A1TDP1ALOX15BLM
SCHEMBL542867 0.79
SCHEMBL5865632 0.79 SLC22A6 (0.50) LMNAALDH1A1TDP1ALOX15BLM
SCHEMBL15754347 0.78 LMNA (0.48) LMNATDP1KDM4EUSP2OR51E2
SCHEMBL2273513 0.78 USP2 (0.46) ALOX15BLMPMP22CYP2C19USP2
SCHEMBL2273519 0.78 USP2 (0.46) ALOX15BLMPMP22CYP2C19USP2

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-1005493-A1 ANTIVIRAL PROTEASE INHIBITORS MEDIVIR AB (SE) 2000-06-07 EP disclosed
WO-1998045330-A1 ANTIVIRAL PROTEASE INHIBITORS MEDIVIR AB (SE) 1998-10-15 WO disclosed