Methane

Methane

SCHEMBL28118878

C.NC1(N)C=CC(c2cccc(Cl)c2)=CC1Cl

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
TDO2 P48775 1/20 0.36
DHFR P00374 1/20 0.35
MAOB P27338 3/20 0.34
IDO1 P14902 3/20 0.34
ALOX5 P09917 1/20 0.34
IKBKE Q14164 1/20 0.34
KDM1A O60341 1/20 0.34
MAP4K4 O95819 1/20 0.33
HRH1 P35367 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
PGR P06401 1/20 0.33
HTR2C P28335 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL1628431 0.98 NOTUM (0.38) NOTUMTAAR1TDO2DHFRMAOB
Methane SCHEMBL27715684 0.83 HTT (0.30)
SCHEMBL4603856 0.81 ALOX5 (0.38) NOTUMTAAR1TDO2IDO1ALOX5
SCHEMBL10410660 0.74 ALDH1A1 (0.37) NOTUMTDO2DHFRMAOBKDM1A
SCHEMBL28455442 0.70 PGR (0.36) NOTUMTAAR1TDO2DHFRMAOB
Methane SCHEMBL28984951 0.66 KMT2A (0.36) IDO1KDM1AMAP4K4ADORA1ALDH1A1
SCHEMBL27790664 0.65
SCHEMBL10398013 0.64 CA1 (0.36) TAAR1ALOX5PGR
SCHEMBL817554 0.64 ALOX5 (0.65) NOTUMTAAR1MAOBIDO1ALOX5
SCHEMBL31222672 0.64 ALOX5 (0.65) NOTUMTAAR1MAOBIDO1ALOX5

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-117264519-A Plastic-absorbing gloss oil for low-temperature heat seal and preparation method thereof 广州粤金彩材料科技有限公司 2023-12-22 CN claimed
CN-118307737-A Degradable and recyclable polyether polyurethane and preparation method thereof 华南理工大学 2024-07-09 CN disclosed
CN-117264519-A Plastic-absorbing gloss oil for low-temperature heat seal and preparation method thereof 广州粤金彩材料科技有限公司 2023-12-22 CN disclosed
CN-106188458-A A kind of stabiliser compositions of polyurethane curing agent 山东省临沂市三丰化工有限公司 2016-12-07 CN disclosed