SCHEMBL6651648

SCHEMBL6651648

CCC(C)C(O)CCCC(C)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
TRPV1 Q8NER1 1/20 0.37
TRPA1 O75762 1/20 0.37
SPHK1 Q9NYA1 2/20 0.37
TDP1 Q9NUW8 1/20 0.30
CYP2D6 P10635 2/20 0.30
LMNA P02545 2/20 0.30
GMNN O75496 1/20 0.30
POLB P06746 1/20 0.30
THPO P40225 1/20 0.30
MTOR P42345 1/20 0.30
BLM P54132 1/20 0.30
KDM4E B2RXH2 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
CETP P11597 1/20 0.30
HTT P42858 1/20 0.30
UBE2N P61088 1/20 0.30

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
SCHEMBL107336 0.85 LMNA (0.42) TSHRTRPV1TRPA1SPHK1CYP2D6
SCHEMBL30987409 0.84 TRPV1 (0.52) TSHRTRPV1TRPA1SPHK1CYP2D6
SCHEMBL29222445 0.84 TRPV1 (0.43) TSHRTRPV1TRPA1SPHK1CYP2D6
SCHEMBL7753996 0.83 TRPV1 (0.36) TSHRTRPV1TRPA1SPHK1
SCHEMBL1657239 0.82 TSHR (0.45) TSHRTDP1
SCHEMBL31509014 0.82 SPHK1 (0.48) TSHRTRPV1TRPA1SPHK1TDP1
SCHEMBL107677 0.82 SPHK1 (0.48) TSHRTRPV1TRPA1SPHK1TDP1
SCHEMBL31509114 0.82 SPHK1 (0.48) TSHRTRPV1TRPA1SPHK1TDP1
SCHEMBL4883986 0.81 TSHR (0.47) TSHRTRPV1TRPA1SPHK1TDP1
SCHEMBL5907121 0.80 PTPN1 (0.41) TSHRTRPV1TRPA1SPHK1TDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082084-B1 ANHYDROUS AEROSOL HAIRSPRAY COMPOSITIONS CONTAINING SILICONE GRAFTED COPOLYMERS PROCTER & GAMBLE (US) 2004-06-09 EP disclosed
WO-1999018929-A1 PERSONAL CLEANSING COMPOSITIONS COMPRISING MID-CHAIN BRANCHED SURFACTANTS THE PROCTER & GAMBLE COMPANY (US) 1999-04-22 WO disclosed
EP-0611298-A1 MULTICYCLE REFASTENABLE TAPE CLOSURE SYSTEMS. MINNESOTA MINING & MFG (US) 1994-08-24 EP disclosed
WO-1993008781-A1 MULTICYCLE REFASTENABLE TAPE CLOSURE SYSTEMS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-05-13 WO disclosed