Methane

Methane

SCHEMBL7582930

C.CCN1CCN([S+]([O-])c2cc3cc-3c2OC)CC1c1ccccc1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.39
HTR2B P41595 1/20 0.33
NR1H2 P55055 5/20 0.32
NR1H3 Q13133 5/20 0.32
MAPK1 P28482 1/20 0.31

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
Ethane SCHEMBL7584694 0.98 P2RX7 (0.39) P2RX7HTR2BNR1H2NR1H3MAPK1
SCHEMBL27419636 0.76 P2RX7 (0.40) P2RX7HTR2BMAPK1
SCHEMBL7587566 0.72 P2RX7 (0.52) P2RX7
Ethane SCHEMBL7590902 0.72 ALDH1A1 (0.40) P2RX7NR1H2NR1H3MAPK1
SCHEMBL7587657 0.71 DPP4 (0.38) P2RX7
SCHEMBL27430288 0.71 P2RX7 (0.39) P2RX7HTR2BNR1H2NR1H3
Methane SCHEMBL7585776 0.70 HTR2A (0.33) HTR2B
Ethane SCHEMBL7582048 0.68 HTR2A (0.33) HTR2B
SCHEMBL7587091 0.68 P2RX7 (0.41) P2RX7MAPK1
SCHEMBL7582092 0.67 P2RX7 (0.40) P2RX7

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-0675118-B1 Biphenylderivatives, process for their preparation and their use as medicaments EISAI CO LTD (JP) 2002-10-09 EP claimed