SCHEMBL670602

SCHEMBL670602

CCCCCC(CC)OC(=O)C=Cc1ccc(OC)cc1.CCCCCC(CC)OC(=O)c1ccccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.52
MAPT P10636 3/20 0.52
CASP3 P42574 2/20 0.52
SENP7 Q9BQF6 2/20 0.52
SENP6 Q9GZR1 2/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
MAOA P21397 1/20 0.52
CYP2C19 P33261 1/20 0.52
SENP8 Q96LD8 1/20 0.52
TDP1 Q9NUW8 3/20 0.50
TAS1R3 Q7RTX0 3/20 0.43
TAS1R1 Q7RTX1 3/20 0.43
LMNA P02545 3/20 0.43
TRPM8 Q7Z2W7 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL28438246 0.92 TDP1 (0.48) MAOBMAPTCASP3SENP7SENP6
Octinoxate SCHEMBL4669379 0.90 TDP1 (0.68) MAOBMAPTCASP3SENP7SENP6
SCHEMBL35994 0.88 TDP1 (0.62) MAOBMAPTTDP1TAS1R3TAS1R1
SCHEMBL14698300 0.88 TDP1 (0.62) MAOBMAPTTDP1TAS1R3TAS1R1
SCHEMBL35995 0.88 TDP1 (0.62) MAOBMAPTTDP1TAS1R3TAS1R1
Phenol SCHEMBL8729267 0.87 TDP1 (0.54) MAOBMAPTTDP1TAS1R3TAS1R1
SCHEMBL28036638 0.87 TDP1 (0.61) MAOBMAPTTDP1TAS1R3TAS1R1
4-Methoxycinnamic Acid SCHEMBL21195188 0.86 TDP1 (0.55) MAOBMAPTTDP1TAS1R3TAS1R1
SCHEMBL28200368 0.86 TDP1 (0.60) MAOBMAPTTDP1TAS1R3TAS1R1
4-Methoxycinnamic Acid SCHEMBL19717781 0.85 TDP1 (0.58) MAOBMAPTTDP1TAS1R3TAS1R1

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
WO-2012023116-A1 COSMETIC METHOD L'OREAL (FR) 2012-02-23 WO disclosed
CN-101677915-A Cosmetic composition comprising fine powder ARKEMA FRANCE 2010-03-24 CN disclosed