SCHEMBL6505602

SCHEMBL6505602

CCOC(=O)C(=O)CC(O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
MAPT P10636 3/20 0.49
LMNA P02545 2/20 0.48
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MMP8 P22894 1/20 0.46
NPC1 O15118 3/20 0.45
CTDSP1 Q9GZU7 1/20 0.44
HTT P42858 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.44
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 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
SCHEMBL28977475 0.84 ALDH1A1 (0.54) ALDH1A1MAPTLMNAKDM4EMEN1
SCHEMBL6584154 0.83 ALDH1A1 (0.51) ALDH1A1MAPTLMNAKDM4EMEN1
SCHEMBL10391474 0.83 ALDH1A1 (0.53) ALDH1A1MAPTLMNAKDM4EMEN1
SCHEMBL7056947 0.83 ALDH1A1 (0.53) ALDH1A1MAPTLMNAKDM4EMEN1
SCHEMBL295741 0.83 ALDH1A1 (0.53) ALDH1A1MAPTLMNAKDM4EMEN1
SCHEMBL23617411 0.83 KMT2A (0.47) LMNAKDM4EKMT2ANPC1RAB9A
SCHEMBL27658015 0.82 MEN1 (0.46) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL9559495 0.81 KMT2A (0.45) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7635592 0.77 CASR (0.48) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL11041623 0.76 LMNA (0.50) LMNAKDM4ENPC1RAB9ASMN1; 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-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed