SCHEMBL5493445

SCHEMBL5493445

CCCCCCCCCCCCCCCCCCCCNC(C)N(CC)CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.41
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
ADH1B P00325 1/20 0.37
ADH1C P00326 1/20 0.37
ADH1A P07327 1/20 0.37
ADH4 P08319 1/20 0.37
ADH7 P40394 1/20 0.37
THRB P10828 1/20 0.35
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
XBP1 P17861 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ABCB11 O95342 1/20 0.34
EGFR P00533 1/20 0.34
ESR1 P03372 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL27497465 1.00 EPHX1 (0.41) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL9244557 1.00 EPHX1 (0.41) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL27621804 1.00 EPHX1 (0.41) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL27499290 1.00 EPHX1 (0.41) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL28988992 1.00 EPHX1 (0.41) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL27515295 1.00 EPHX1 (0.41) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL3784124 0.98 ALDH1A1 (0.40) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL29234732 0.82 EPHX1 (0.31) EPHX1
SCHEMBL9407143 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL7129552 0.80 LMNA (0.38) EPHX1TSHRALDH1A1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115551469-A Hair care compositions comprising a polyol, a C2-6 monohydric alcohol and a cationic surfactant 莱雅公司 2022-12-30 CN disclosed
EP-1723972-B1 Vectorisation of dsRNA by cationic particles and their use for the production of a skin model L'ORÉAL (FR) 2018-01-24 EP disclosed
EP-1774959-B1 DOUBLE STRANDED RNA OLIGONUCLEOTIDE FOR THE INHIBITION OF TYROSINASE EXPRESSION L'ORÉAL (FR) 2018-01-24 EP disclosed
EP-1774959-A1 Double stranded RNA oligonucleotide to inhibit tyrosinase expression L'Oréal (FR) 2007-04-18 EP disclosed
EP-1723958-A2 dsRNA vectorisation with cationic particles and their topical use L'OREAL (FR) 2006-11-22 EP disclosed
EP-1723972-A1 Vectorisation of dsRNA by cationic particles and their use in a skin model L'OREAL (FR) 2006-11-22 EP disclosed