Methane

Methane

SCHEMBL21294037

C.CCc1cc(-c2cc(C)c(N)c(CC)c2)cc(C)c1N

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
CYP3A4 P08684 2/20 0.56
TSHR P16473 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
TP53 P04637 1/20 0.56
HTT P42858 2/20 0.50
MAPT P10636 1/20 0.50
POLB P06746 2/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP7 P55210 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
BRD4 O60885 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
SCHEMBL9325247 0.98 ALDH1A1 (0.59) ALDH1A1CYP3A4TSHRTDP1TP53
Sulfur Dioxide SCHEMBL20572546 0.91 ALDH1A1 (0.52) ALDH1A1CYP3A4TSHRTDP1TP53
Sulfuric Acid SCHEMBL11142659 0.88 ALDH1A1 (0.48) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL24385313 0.86 ALDH1A1 (0.46) ALDH1A1CYP3A4TSHRTDP1TP53
Methane SCHEMBL27855766 0.85 HTT (0.52) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL2186186 0.83 HTT (0.54) ALDH1A1CYP3A4TSHRTDP1TP53
Hydrochloric Acid SCHEMBL9751581 0.80 HTT (0.52) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL29656878 0.80 HTT (0.52) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL21533173 0.79 ALDH1A1 (0.41) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL5158799 0.79 ALDH1A1 (0.52) ALDH1A1CYP3A4TSHRTDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220227942-A1 RESIN COMPOSITION, PREPREG, LAMINATE, METAL FOIL-CLAD LAMINATE, AND PRINTED CIRCUIT BOARD SHENGYI TECHNOLOGY CO., LTD. (CN) 2022-07-21 US disclosed
US-10920007-B2 Urethane resin comprising a polyrotaxane and polishing pad TOKUYAMA CORPORATION (JP) 2021-02-16 US disclosed
EP-3543267-A1 URETHANE RESIN USING POLYROTAXANE, AND POLISHING PAD Tokuyama Corporation (JP) 2019-09-25 EP disclosed
US-20190263961-A1 URETHANE RESIN COMPRISING A POLYROTAXANE AND POLISHING PAD TOKUYAMA CORPORATION (JP) 2019-08-29 US disclosed
CN-1597735-A Preparation method of soluble polyimide SHANGHAI HUAYI GUOUP CORP (CN) 2005-03-23 CN disclosed