SCHEMBL6312146

SCHEMBL6312146

[CH2]CCC([CH2])NCCCCCCCCCCCC

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.39
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH4 P08319 1/20 0.35
ADH7 P40394 1/20 0.35
GBA1 P04062 6/20 0.35
DNM1 Q05193 2/20 0.34
THRB P10828 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33

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
SCHEMBL6422454 0.98 ALDH1A1 (0.39) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL10527068 0.87 EPHX1 (0.42) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL3811066 0.87 EPHX1 (0.42) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL8964539 0.85 ALDH1A1 (0.42) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL9469715 0.82 TSHR (0.52) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL9470772 0.82 TSHR (0.52) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL9470271 0.82 TSHR (0.52) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL9470907 0.82 TSHR (0.52) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL6050483 0.77 ALDH1A1 (0.39) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL28149401 0.77 EPHX1 (0.41) EPHX1ALDH1A1TSHRADH1BADH1C

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-1515684-A2 CARE AND/OR MAKE-UP COSMETIC COMPOSITION STRUCTURED WITH SILICONE POLYMERS AND ORGANOGELLING AGENTS, IN RIGID FORM L'OREAL (FR) 2005-03-23 EP claimed
WO-2003105788-A2 CARE AND/OR MAKE-UP COSMETIC COMPOSITION STRUCTURED WITH SILICONE POLYMERS AND ORGANOGELLING AGENTS, IN RIGID FORM L'OREAL (FR) 2003-12-24 WO claimed