SCHEMBL18595252

SCHEMBL18595252

CCCCCCCCC(CCCC)CC(C)(O)CO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
ALDH1A1 P00352 2/20 0.42
FDPS P14324 4/20 0.42
CA2 P00918 1/20 0.40
DNM1 Q05193 2/20 0.37
CYP2D6 P10635 2/20 0.36
SPHK1 Q9NYA1 1/20 0.36
GMNN O75496 1/20 0.36
POLB P06746 1/20 0.36
THPO P40225 1/20 0.36
MTOR P42345 1/20 0.36
BLM P54132 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CETP P11597 1/20 0.36
HTT P42858 1/20 0.36
UBE2N P61088 1/20 0.36

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
SCHEMBL18595200 1.00 LMNA (0.52) LMNAALDH1A1FDPSCA2DNM1
SCHEMBL12477442 0.81 LMNA (0.47) LMNAALDH1A1FDPSCA2DNM1
SCHEMBL21166547 0.80 LMNA (0.56) LMNAALDH1A1FDPSCA2CYP2D6
SCHEMBL21166526 0.80 LMNA (0.56) LMNAALDH1A1FDPSCA2CYP2D6
SCHEMBL10457247 0.79 LMNA (0.54) LMNAALDH1A1FDPSCA2DNM1
SCHEMBL4024156 0.77 LMNA (0.56) LMNAALDH1A1FDPSDNM1SPHK1
SCHEMBL5176712 0.76 LMNA (0.50) LMNAALDH1A1FDPSCA2DNM1
SCHEMBL12477841 0.76 LMNA (0.50) LMNAFDPSCA2CYP2D6SPHK1
SCHEMBL29286434 0.76 LMNA (0.50) LMNAFDPSCA2CYP2D6SPHK1
SCHEMBL25543593 0.76 LMNA (0.45) LMNAALDH1A1FDPSCA2DNM1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9586931-B2 Triazolyl derivatives as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2017-03-07 US disclosed