Methane

Methane

SCHEMBL29089947

C.c1ccc(C(OC(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 8/20 0.44
TDO2 P48775 8/20 0.44
DPP4 P27487 2/20 0.43
TSHR P16473 2/20 0.43
F2 P00734 1/20 0.43
SCN1A P35498 3/20 0.41
SCN2A Q99250 3/20 0.41
SCN3A Q9NY46 3/20 0.41
IDO2 Q6ZQW0 2/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
ADRA2A P08913 1/20 0.41
CYP2D6 P10635 1/20 0.41
CHRM1 P11229 1/20 0.41
ADRA2B P18089 1/20 0.41
CHRM3 P20309 1/20 0.41
SLC6A2 P23975 1/20 0.41

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
SCHEMBL127629 0.97 IDO1 (0.46) IDO1TDO2DPP4TSHRF2
Ammonia Solution, Strong SCHEMBL7282272 0.94 IDO1 (0.44) IDO1TDO2DPP4TSHRF2
Water SCHEMBL11878861 0.94 IDO1 (0.44) IDO1TDO2DPP4TSHRF2
SCHEMBL434700 0.84 CHRNB2 (0.52) IDO1TDO2CYP1A2CYP2D6SLC6A2
SCHEMBL3597509 0.82 HTR2A (0.54) IDO1TDO2CHRM2ADRA2ACHRM1
SCHEMBL11500414 0.82 LMNA (0.46) IDO1TDO2TSHRSCN1ASCN2A
SCHEMBL29020572 0.82 IDO1 (0.38) IDO1TDO2DPP4TSHRF2
SCHEMBL10981079 0.82 IDO1 (0.67) IDO1TDO2LMNA
SCHEMBL3924304 0.82 IDO1 (0.47) IDO1TDO2DPP4TSHRF2
SCHEMBL12227917 0.80 SCN1A (0.42) IDO1TDO2TSHRSCN1ASCN2A

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
CN-116916880-A Cosmetic product 株式会社资生堂 2023-10-20 CN disclosed
CN-116916879-A Cosmetic product 株式会社资生堂 2023-10-20 CN disclosed