SCHEMBL1613700

SCHEMBL1613700

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
LMNA P02545 3/20 0.39
TSHR P16473 3/20 0.34
CA2 P00918 5/20 0.33
MAPK1 P28482 1/20 0.33
CA1 P00915 3/20 0.32
TDP1 Q9NUW8 1/20 0.31
CYP2D6 P10635 2/20 0.31
CYP3A4 P08684 2/20 0.31
SPHK1 Q9NYA1 1/20 0.31
GMNN O75496 1/20 0.31
POLB P06746 1/20 0.31
THPO P40225 1/20 0.31
MTOR P42345 1/20 0.31
BLM P54132 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
MAPT P10636 1/20 0.31
CETP P11597 1/20 0.31

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
SCHEMBL1614862 0.87 LMNA (0.46) ALDH1A1LMNATSHR
SCHEMBL1615024 0.83 ALDH1A1 (0.43) ALDH1A1LMNATSHRCA2MAPK1
SCHEMBL1614472 0.80 LMNA (0.41) LMNATSHRTDP1KDM4ESMN1; SMN2
SCHEMBL8635332 0.79 ALDH1A1 (0.45) ALDH1A1LMNATSHRCA2MAPK1
SCHEMBL28416995 0.78 ALDH1A1 (0.46) ALDH1A1LMNATSHRCA2MAPK1
SCHEMBL818906 0.78 ALDH1A1 (0.46) ALDH1A1LMNATSHRCA2MAPK1
SCHEMBL1614491 0.78 ALDH1A1 (0.46) ALDH1A1LMNATSHRCA2MAPK1
SCHEMBL27592492 0.77 ALDH1A1 (0.41) ALDH1A1LMNATSHRTDP1CYP2D6
SCHEMBL6463333 0.77 ALDH1A1 (0.55) ALDH1A1LMNATSHRCA2MAPK1
SCHEMBL3097828 0.76 ALDH1A1 (0.50) ALDH1A1LMNATSHRCA2MAPK1

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