Methane

Methane

SCHEMBL6947967

C.CC(C)(C)c1ccc(CCCCCCCC(=O)O)cc1OC=S(=O)=O

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.40
MAPT P10636 1/20 0.40
PPARA Q07869 2/20 0.38
PPARG P37231 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
PRNP P04156 1/20 0.36
RECQL P46063 1/20 0.36
ALOX5 P09917 1/20 0.36
RXRA P19793 1/20 0.35
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
LTB4R Q15722 1/20 0.35
VCAM1 P19320 1/20 0.35

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
SCHEMBL6949592 0.75 RXFP1 (0.50) RXFP1MAPTPPARACYP1A2ALDH1A1
SCHEMBL6942587 0.74 MRGPRX4 (0.44) ALDH1A1RXRATBXAS1
SCHEMBL6944389 0.72 REN (0.38) RXFP1MAPTPPARAPPARGRXRA
SCHEMBL6948450 0.72 RAF1 (0.49) RXFP1MAPTALDH1A1RXRA
SCHEMBL6948258 0.71 PPARA (0.38) RXFP1MAPTPPARAPPARGALDH1A1
SCHEMBL10935708 0.71 MAPT (0.47) RXFP1MAPTCYP1A2CYP2D6CYP2C19
SCHEMBL7415347 0.69 PPARA (0.58) RXFP1MAPTPPARAPPARGALOX5
SCHEMBL11725011 0.68 GAA (0.55) RXFP1MAPTCYP1A2CYP2D6ALDH1A1
SCHEMBL7095615 0.68 PPARA (0.59) PPARAPPARGALOX5POLBSELP
SCHEMBL28432360 0.68 GAA (0.55) RXFP1MAPTCYP1A2CYP2D6ALDH1A1

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-2003103653-A1 METHODS OF TREATING ALZHEIMER'S DISEASE USING ARYL ALKANOIC ACID AMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed