SCHEMBL6687172

SCHEMBL6687172

CCCCCCCCCCCCCCCPCC(C)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SPHK1 Q9NYA1 2/20 0.39
MAPT P10636 2/20 0.37
CYP2D6 P10635 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
CETP P11597 1/20 0.36
HTT P42858 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
SCHEMBL9440860 0.84 TSHR (0.38) LMNATSHRALDH1A1HSD17B10MEN1
SCHEMBL15286171 0.81 TSHR (0.40) LMNATSHRALDH1A1SPHK1THRB
Bromide SCHEMBL28489608 0.80 SPHK1 (0.38) LMNATSHRALDH1A1HSD17B10MEN1
SCHEMBL11525592 0.80 SPHK1 (0.38) LMNATSHRALDH1A1HSD17B10MEN1
Hydrochloric Acid SCHEMBL27986910 0.79 TSHR (0.38) TSHRTHRBTRPM8
SCHEMBL15285662 0.78 TRPM8 (0.36) LMNATSHRTHRBTRPM8
Hydrochloric Acid SCHEMBL27987295 0.76 TRPM8 (0.34) TSHRTHRBTRPM8
SCHEMBL30047060 0.76 TSHR (0.35) TSHRTHRBTRPM8
Octane SCHEMBL23406315 0.75 TDP1 (0.62) LMNATSHRALDH1A1HSD17B10MEN1
Dodecane SCHEMBL1656240 0.75 TDP1 (0.62) LMNATSHRALDH1A1HSD17B10MEN1

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-1478725-A1 SOAP COMPOSITION Colgate-Palmolive Company (US) 2004-11-24 EP disclosed
WO-2003072692-A1 SOAP COMPOSITION COLGATE-PALMOLIVE COMPANY (US) 2003-09-04 WO disclosed