Ethane

Ethane

SCHEMBL5264203

CC.CC(C)c1ccccc1O

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.95
GABRB2 P47870 2/20 0.95
TSHR P16473 2/20 0.60
LMNA P02545 4/20 0.56
CA2 P00918 4/20 0.56
CYP3A4 P08684 4/20 0.56
HPGD P15428 3/20 0.56
HIF1A Q16665 3/20 0.56
CA1 P00915 3/20 0.56
SLC6A2 P23975 2/20 0.56
HTR2B P41595 2/20 0.56
BLM P54132 2/20 0.56
GABRG2 P18507 2/20 0.56
GABRB3 P28472 2/20 0.56
GABRB1 P18505 2/20 0.56
CYP1A2 P05177 2/20 0.56
FAAH O00519 1/20 0.56
PTGS1 P23219 1/20 0.56
HTR2C P28335 1/20 0.56
GABRA5 P31644 1/20 0.56

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
SCHEMBL15485453 0.97 GABRA1 (1.00) GABRA1GABRB2TSHRLMNACA2
SCHEMBL43297 0.97 GABRA1 (1.00) GABRA1GABRB2TSHRLMNACA2
SCHEMBL29531559 0.97 GABRA1 (1.00) GABRA1GABRB2TSHRLMNACA2
Benzene SCHEMBL1841233 0.95 GABRA1 (0.95) GABRA1GABRB2TSHRLMNACA2
SCHEMBL27858014 0.95 GABRA1 (0.95) GABRA1GABRB2TSHRLMNACA2
SCHEMBL27568004 0.95 GABRA1 (0.95) GABRA1GABRB2TSHRLMNACA2
SCHEMBL28800546 0.95 GABRA1 (0.95) GABRA1GABRB2TSHRLMNACA2
Hydrogen Peroxide SCHEMBL28937397 0.95 GABRA1 (0.95) GABRA1GABRB2TSHRLMNACA2
Ammonia Solution, Strong SCHEMBL27336219 0.95 GABRA1 (0.95) GABRA1GABRB2TSHRLMNACA2
Water SCHEMBL27338161 0.95 GABRA1 (0.95) GABRA1GABRB2TSHRLMNACA2

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-1836183-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS Galileo Pharmaceuticals, Inc. (US) 2007-09-26 EP disclosed
WO-2006065686-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS GALILEO PHARMACEUTICALS, INC. (US) 2006-06-22 WO disclosed