Methane

Methane

SCHEMBL28656788

C.COC(=O)Cc1ccc2c(c1)[nH]c1ccc(Cl)cc12

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ABCC4 O15439 1/20 0.50
C5 P01031 1/20 0.50
PTGS1 P23219 1/20 0.50
PDE4D Q08499 1/20 0.50
CNR1 P21554 3/20 0.47
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 2/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 1/20 0.46
SIRT1 Q96EB6 3/20 0.43
TSHR P16473 1/20 0.42
NR4A2 P43354 1/20 0.42
GAA P10253 1/20 0.42
GFER P55789 1/20 0.42

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
SCHEMBL11018311 0.99 PTGS2 (0.51) PTGS2MAPTMEN1KMT2AABCC4
SCHEMBL31324154 0.99 PTGS2 (0.51) PTGS2MAPTMEN1KMT2AABCC4
SCHEMBL31324178 0.94 MAPT (0.50) PTGS2MAPTMEN1KMT2AABCC4
SCHEMBL31324166 0.92 ALDH1A1 (0.54) PTGS2MAPTMEN1KMT2AABCC4
Methane SCHEMBL28638234 0.88 ALOX15 (0.50) PTGS2MAPTMEN1KMT2AABCC4
Methane SCHEMBL28732838 0.84 ALDH1A1 (0.65) MAPTALDH1A1KDM4EHPGDHSD17B10
Methane SCHEMBL506242 0.84 MEN1 (0.67) PTGS2MAPTMEN1KMT2AABCC4
SCHEMBL24439539 0.82 ALDH1A1 (0.67) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL31324164 0.82 MEN1 (0.69) PTGS2MAPTMEN1KMT2AABCC4
SCHEMBL13697649 0.80 KDM4E (0.55) MAPTMEN1KMT2AALDH1A1KDM4E

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-113372261-B Method for preparing 1-bromo/chloro carbazole and derivatives thereof 中国科学院兰州化学物理研究所 2023-06-27 CN disclosed
CN-113620811-B Halogenation method of aromatic compound 中国科学院兰州化学物理研究所 2022-05-24 CN disclosed
CN-113620811-A Halogenation method of aromatic compound 中国科学院兰州化学物理研究所 2021-11-09 CN disclosed
CN-113372261-A Method for preparing 1-bromine/chlorocarbazole and derivatives thereof 中国科学院兰州化学物理研究所 2021-09-10 CN disclosed