Ethane

Ethane

SCHEMBL28294427

CC.Cc1cc(-c2cccc(-c3cc(C)c(O)cc3C)c2O)c(C)cc1O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
KDM4E B2RXH2 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
MAPT P10636 1/20 0.54
G6PD P11413 1/20 0.54
CYP2C9 P11712 1/20 0.54
PKM P14618 1/20 0.54
HPGD P15428 1/20 0.54
ALOX15 P16050 1/20 0.54
ALOX12 P18054 1/20 0.54
MAPK1 P28482 1/20 0.54
CYP2C19 P33261 1/20 0.54
CCR6 P51684 1/20 0.54
HIF1A Q16665 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
HSD17B10 Q99714 1/20 0.54
TRPA1 O75762 2/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL27563475 0.90 ALDH1A1 (0.52) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL30693660 0.82 KDM4E (0.68) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL4388616 0.82 KDM4E (0.68) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL31545845 0.80 ALDH1A1 (0.75) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL16581351 0.77 CYP3A4 (0.56) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
Orthocresol SCHEMBL15512299 0.77 MAPT (0.56) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL8894430 0.76 KDM4E (0.50) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
Metacresol SCHEMBL15512632 0.76 ACHE (0.65) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
Ethane SCHEMBL28124193 0.75 ALDH1A1 (0.54) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6
Ethane SCHEMBL28289826 0.75 KDM4E (0.48) ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103923426-B Resin combination, cured film, its forming method, semiconductor element and display element JSR株式会社 2019-06-07 CN disclosed