SCHEMBL1734673

SCHEMBL1734673

CCCCCCC(C)OC(=O)C=Cc1ccc(OC)cc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.59
LMNA P02545 2/20 0.56
TAS1R3 Q7RTX0 4/20 0.53
TAS1R1 Q7RTX1 4/20 0.53
MAOB P27338 1/20 0.51
GSK3B P49841 2/20 0.50
F3 P13726 2/20 0.49
THRB P10828 1/20 0.48
ATM Q13315 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
BACE1 P56817 1/20 0.47
BCHE P06276 1/20 0.46
CYP3A4 P08684 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46

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
SCHEMBL27495594 1.00 TDP1 (0.59) TDP1LMNATAS1R3TAS1R1MAOB
SCHEMBL19579511 0.99 TDP1 (0.60) TDP1LMNATAS1R3TAS1R1MAOB
SCHEMBL10613933 0.87 CA12 (0.61) TDP1MAOB
SCHEMBL10613929 0.87 CA12 (0.61) TDP1MAOB
SCHEMBL28048304 0.86 ALDH1A1 (0.56) LMNAMAOBMEN1KMT2ABCHE
SCHEMBL35994 0.85 TDP1 (0.62) TDP1LMNATAS1R3TAS1R1MAOB
SCHEMBL14698300 0.85 TDP1 (0.62) TDP1LMNATAS1R3TAS1R1MAOB
SCHEMBL35995 0.85 TDP1 (0.62) TDP1LMNATAS1R3TAS1R1MAOB
SCHEMBL29160593 0.84 ALDH1A1 (0.54) LMNAMAOBMEN1MAPTKMT2A
SCHEMBL19244435 0.84 TDP1 (0.60) TDP1LMNATAS1R3TAS1R1MAOB

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
US-8198335-B2 Cosmetic material PARAHERMOSA CO., LTD. (JP) 2012-06-12 US disclosed
EP-2172185-B1 Cosmetic material comprising octyl hydroxy stearate oligomer PARAHERMOSA CO LTD (JP) 2011-11-23 EP disclosed
US-20100087551-A1 COSMETIC MATERIAL PARAHERMOSA CO., LTD. (JP) 2010-04-08 US disclosed
EP-2172185-A2 Cosmetic material comprising octyl hydroxy stearate oligomer Parahermosa Co., Ltd. (JP) 2010-04-07 EP disclosed