SCHEMBL1615024

SCHEMBL1615024

CCCCC(CO)C(CO)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
LMNA P02545 3/20 0.38
TSHR P16473 1/20 0.37
CYP2D6 P10635 2/20 0.32
SPHK1 Q9NYA1 1/20 0.32
GMNN O75496 1/20 0.32
POLB P06746 1/20 0.32
THPO P40225 1/20 0.32
MTOR P42345 1/20 0.32
BLM P54132 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
CETP P11597 1/20 0.32
HTT P42858 1/20 0.32
UBE2N P61088 1/20 0.32
FDPS P14324 1/20 0.32
DNM1 Q05193 2/20 0.32

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
SCHEMBL1615147 0.86 TSHR (0.46) ALDH1A1LMNATSHR
SCHEMBL7707663 0.83 ALDH1A1 (0.48) ALDH1A1LMNATSHRCYP2D6SPHK1
SCHEMBL15469684 0.83 ALDH1A1 (0.48) ALDH1A1LMNATSHRCYP2D6SPHK1
SCHEMBL18124655 0.83 ALDH1A1 (0.48) ALDH1A1LMNATSHRCYP2D6SPHK1
SCHEMBL1613700 0.83 ALDH1A1 (0.45) ALDH1A1LMNATSHRCYP2D6SPHK1
SCHEMBL28416995 0.81 ALDH1A1 (0.46) ALDH1A1LMNATSHRCYP2D6SPHK1
SCHEMBL27592492 0.80 ALDH1A1 (0.41) ALDH1A1LMNATSHRCYP2D6SPHK1
SCHEMBL6463333 0.80 ALDH1A1 (0.55) ALDH1A1LMNATSHRCYP2D6SPHK1
SCHEMBL29247954 0.78 TSHR (0.33) LMNATSHR
SCHEMBL21694617 0.78 ALDH1A1 (0.52) ALDH1A1LMNATSHRCYP2D6SPHK1

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-20110086975-A1 COLORED GEL COAT COMPOSITION AND ARTICLE VALSPAR SOURCING, INC. 2011-04-14 US disclosed