SCHEMBL8375339

SCHEMBL8375339

CCCOC(=O)C=Cc1ccc(OC)cc1.COc1ccc(C=C(CCC(C)C)C(=O)O)cc1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.66
LMNA P02545 2/20 0.66
SMN1; SMN2 Q16637 1/20 0.48
TAS1R3 Q7RTX0 4/20 0.45
TAS1R1 Q7RTX1 4/20 0.45
APP P05067 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALOX5 P09917 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GAA P10253 1/20 0.43
THRB P10828 1/20 0.43
ATM Q13315 1/20 0.43
MAPT P10636 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GSK3B P49841 1/20 0.42

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
Amiloxate SCHEMBL29696497 0.94 LMNA (0.76) TDP1LMNASMN1; SMN2TAS1R3TAS1R1
SCHEMBL6162547 0.86 TDP1 (0.57) TDP1LMNASMN1; SMN2TAS1R3TAS1R1
SCHEMBL196087 0.84 LMNA (0.50) TDP1LMNASMN1; SMN2TAS1R3TAS1R1
SCHEMBL30485146 0.82 LMNA (0.57) TDP1LMNAAPPMEN1KMT2A
SCHEMBL39355 0.82 LMNA (0.72) TDP1LMNASMN1; SMN2TAS1R3TAS1R1
SCHEMBL39354 0.82 LMNA (0.72) TDP1LMNASMN1; SMN2TAS1R3TAS1R1
Cinoxate SCHEMBL30139914 0.81 LMNA (0.53) TDP1LMNASMN1; SMN2APPMEN1
Amiloxate SCHEMBL2228053 0.81 LMNA (1.00) TDP1LMNASMN1; SMN2TAS1R3TAS1R1
Amiloxate SCHEMBL15765 0.81 LMNA (1.00) TDP1LMNASMN1; SMN2TAS1R3TAS1R1
Amiloxate SCHEMBL15764 0.81 LMNA (1.00) TDP1LMNASMN1; SMN2TAS1R3TAS1R1

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-0901512-A1 DETERGENT COMPOSITION UNILEVER PLC (GB) 1999-03-17 EP disclosed
WO-1997044422-A1 DETERGENT COMPOSITION UNILEVER PLC (GB) 1997-11-27 WO disclosed