SCHEMBL21986994

SCHEMBL21986994

CCCCC(CCCO)C(O)CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 4/20 0.41
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40
PTPN1 P18031 1/20 0.39
CYP2D6 P10635 2/20 0.36
SPHK1 Q9NYA1 2/20 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

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
SCHEMBL6664800 0.91 LMNA (0.46) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL22418856 0.86 LMNA (0.44) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL7191735 0.86 LMNA (0.44) ALDH1A1SMN1; SMN2LMNATSHRCYP2D6
SCHEMBL28405833 0.84 LMNA (0.48) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL273960 0.84 LMNA (0.54) ALDH1A1SMN1; SMN2LMNATSHRCYP2D6
SCHEMBL5699531 0.84 LMNA (0.42) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL2396809 0.83 LMNA (0.46) ALDH1A1SMN1; SMN2LMNATSHRCYP2D6
SCHEMBL27864737 0.82 LMNA (0.52) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL28214899 0.82 LMNA (0.50) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL26211760 0.81 SPHK1 (0.52) LMNACYP2D6SPHK1GMNNPOLB

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
EP-3658604-A1 HEAT-CROSSLINKABLE ADHESIVE COMPOSITION Bostik SA (FR) 2020-06-03 EP disclosed