SCHEMBL8557710

SCHEMBL8557710

CC(CO)CC(CO)C(O)CCCO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
TSHR P16473 1/20 0.34
TRPA1 O75762 3/20 0.32
TRPV1 Q8NER1 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
CYP2D6 P10635 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
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
CETP P11597 1/20 0.31
HTT P42858 1/20 0.31
UBE2N P61088 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
SCHEMBL7870407 0.83 TSHR (0.42) LMNATSHRTRPA1TRPV1TDP1
SCHEMBL9875117 0.82 LMNA (0.44) LMNATSHRTRPA1TRPV1CYP2D6
SCHEMBL26921972 0.79 LMNA (0.44) LMNATRPA1TRPV1TDP1CYP2D6
SCHEMBL4889543 0.78 LMNA (0.42) LMNATRPA1TRPV1SPHK1PTPN1
SCHEMBL21477 0.77 LMNA (0.42) LMNATDP1CYP2D6SPHK1GMNN
SCHEMBL1043717 0.75 LMNA (0.41) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL28919393 0.75 TSHR (0.42) LMNATSHRTRPA1TDP1
SCHEMBL12384888 0.71
SCHEMBL12384887 0.71
SCHEMBL50165 0.71

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
EP-0912709-A2 CLEAR, CONCENTRATED LIQUID FABRIC SOFTENER COMPOSITIONS Colgate-Palmolive Company (US) 1999-05-06 EP disclosed
WO-1997047723-A2 CLEAR, CONCENTRATED LIQUID FABRIC SOFTENER COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 1997-12-18 WO disclosed