Methane

Methane

SCHEMBL8749792

C.CC(c1ccccc1)c1cc(O)ccc1O

nearest known ligand 0.71

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.71
ESR1 P03372 2/20 0.43
PDCD1 Q15116 1/20 0.43
ESR2 Q92731 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
LMNA P02545 3/20 0.40
PTGS1 P23219 2/20 0.40
HTR2A P28223 2/20 0.40
ADRA1A P35348 2/20 0.40
MAPT P10636 2/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
KCNE1 P15382 1/20 0.40
CHRM3 P20309 1/20 0.40
HRH2 P25021 1/20 0.40
SLC6A4 P31645 1/20 0.40

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
SCHEMBL1681823 0.98 TYR (0.73) TYRESR1PDCD1ESR2CD274
SCHEMBL9157459 0.95 TYR (0.74) TYRESR1PDCD1ESR2CD274
SCHEMBL9250453 0.84 TYR (0.60) TYRESR1PDCD1ESR2CD274
SCHEMBL30336405 0.83 TYR (0.58) TYRESR1PDCD1ESR2CD274
SCHEMBL29394395 0.83 TYR (1.00) TYRESR1PDCD1ESR2CD274
SCHEMBL369337 0.83 TYR (1.00) TYRESR1PDCD1ESR2CD274
SCHEMBL9081257 0.83 TYR (0.58) TYRESR1PDCD1ESR2CD274
SCHEMBL18815425 0.83 TYR (1.00) TYRESR1PDCD1ESR2CD274
SCHEMBL9243488 0.83 TYR (0.58) TYRESR1ESR2GABRA1GABRB2
SCHEMBL9157477 0.82 TYR (0.54) TYROPRK1ALOX5ALDH1A1CYP2C9

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0578846-B1 Thermotropic liquid crystal aromatic polyesters MONTELL ITALIA SPA (IT) 1997-03-26 EP disclosed
US-5496912-A DERIVED FROM HYDROQUINONE MONOMERS; MELT PROCESSING HIMONT ITALIA S.R.L. (IT) 1996-03-05 US disclosed
EP-0578846-A1 Thermotropic liquid crystal aromatic polyesters HIMONT ITALIA S.r.l. (IT) 1994-01-19 EP disclosed