Ethane

Ethane

SCHEMBL7937068

CC.COc1cccc2c1ccn2Cc1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.60
HTR2C P28335 1/20 0.57
APP P05067 2/20 0.48
KCNA3 P22001 4/20 0.46
PRMT5 O14744 1/20 0.46
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
MEN1 O00255 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
P2RX7 Q99572 1/20 0.45
SNCA P37840 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL6775018 0.98 HTR6 (0.61) HTR6HTR2CAPPKCNA3PRMT5
SCHEMBL6087229 0.87 HTR2C (0.56) HTR6HTR2CKCNA3PRMT5MTNR1A
SCHEMBL22533506 0.82 HTR2C (0.51) HTR6HTR2CAPPPRMT5MTNR1A
SCHEMBL18049242 0.82 HTR6 (0.67) HTR6APPMEN1MAPK1KMT2A
SCHEMBL9056875 0.80 HTR6 (0.55) HTR6APPTP53MAPK1SNCA
SCHEMBL18069184 0.80 HTR6 (0.69) HTR6APPKCNA3MEN1TP53
SCHEMBL22533964 0.80 HTR2C (0.49) HTR6HTR2CPRMT5MTNR1AMTNR1B
SCHEMBL12614378 0.80 KMT2A (0.54) HTR6MEN1TSHRMAPK1KMT2A
SCHEMBL13228252 0.79 HTR2C (0.65) HTR6HTR2CPRMT5MTNR1AMTNR1B
SCHEMBL19910604 0.78 HTR6 (0.65) HTR6HTR2CAPPKCNA3MEN1

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
WO-2001066111-A1 COMPOSITIONS CONTAINING POTENTIAL SPLA2 INHIBITORS FOR THE TREATMENT OF PAIN ELI LILLY AND COMPANY (US) 2001-09-13 WO disclosed