Ethane

Ethane

SCHEMBL10694585

CC.Oc1ccccc1CCc1ccccc1O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.65
HSPA5 P11021 1/20 0.62
HTR1A P08908 1/20 0.57
MPO P05164 4/20 0.56
CYP2D6 P10635 1/20 0.54
TSHR P16473 1/20 0.54
HIF1A Q16665 1/20 0.54
AKR1B1 P15121 1/20 0.52
SLC6A4 P31645 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52
IDO1 P14902 2/20 0.50
CA12 O43570 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 1/20 0.48
KEAP1 Q14145 1/20 0.48

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
SCHEMBL1222973 0.94 TAAR1 (0.71) TAAR1HSPA5HTR1AMPOCYP2D6
SCHEMBL29706272 0.94 TAAR1 (0.71) TAAR1HSPA5HTR1AMPOCYP2D6
SCHEMBL29706378 0.92 TAAR1 (0.68) TAAR1HSPA5HTR1AMPOCYP2D6
Formaldehyde SCHEMBL28980606 0.86 TAAR1 (0.62) TAAR1HSPA5HTR1AMPOCYP2D6
SCHEMBL8702920 0.85 TAAR1 (0.56) TAAR1HSPA5HTR1AMPOCYP2D6
SCHEMBL15478398 0.85 TAAR1 (0.56) TAAR1HSPA5HTR1AMPOCYP2D6
SCHEMBL30595395 0.84 HTR1A (0.64) TAAR1HSPA5HTR1AMPOCYP2D6
SCHEMBL51747 0.84 HTR1A (0.64) TAAR1HSPA5HTR1AMPOCYP2D6
SCHEMBL3800530 0.83 TAAR1 (0.65) TAAR1HSPA5HTR1AMPOCYP2D6
SCHEMBL4967651 0.83 TAAR1 (0.65) TAAR1HSPA5HTR1AMPOCYP2D6

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
EP-0251799-A2 Method and apparatus for producing thermoplastic synthetic yarn TORAY INDUSTRIES, INC. (JP) 1988-01-07 EP disclosed