Methane

Methane

SCHEMBL28330275

C.CC(C)(C)C1CCCN1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP2C19 P33261 1/20 0.38
RAB9A P51151 1/20 0.38
NOS2 P35228 2/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30

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
SCHEMBL1704716 0.97
SCHEMBL1705094 0.97
SCHEMBL164043 0.97
Hydrochloric Acid SCHEMBL5241681 0.95 KDM4E (0.42) KDM4ENPC1CYP1A2CYP2D6HPGD
SCHEMBL10326679 0.90 CYP2D6 (0.34) KDM4ENPC1CYP1A2CYP2D6HPGD
SCHEMBL3229383 0.90 CYP2D6 (0.34) KDM4ENPC1CYP1A2CYP2D6HPGD
SCHEMBL1547510 0.90 CYP2D6 (0.34) KDM4ENPC1CYP1A2CYP2D6HPGD
SCHEMBL24922624 0.87 CYP2D6 (0.33) KDM4ENPC1CYP1A2CYP2D6HPGD
SCHEMBL22260036 0.87 CYP2D6 (0.33) KDM4ENPC1CYP1A2CYP2D6HPGD
SCHEMBL797872 0.87 CYP2D6 (0.33) KDM4ENPC1CYP1A2CYP2D6HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106062044-B Polysiloxane copolymer, and antistatic agent and resin composition containing same 信越化学工业株式会社 2019-11-26 CN disclosed
CN-105916913-B Polysiloxane copolymer and antistatic agent containing it 广荣化学工业株式会社 2019-10-25 CN disclosed
CN-106062044-A Polysiloxane copolymer, and antistatic agent and resin composition containing same 信越化学工业株式会社 2016-10-26 CN disclosed
CN-105916913-A Polysiloxane copolymer and antistatic agent comprising same 广荣化学工业株式会社 2016-08-31 CN disclosed