Methane

Methane

SCHEMBL29190811

C.c1ccc2cc3cnccc3cc2c1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 2/20 0.50
CSNK1D P48730 1/20 0.50
CSNK1E P49674 1/20 0.50
DYRK1A Q13627 1/20 0.50
HASPIN Q8TF76 5/20 0.47
CYP17A1 P05093 1/20 0.45
CYP19A1 P11511 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
MAPT P10636 1/20 0.44
KDM4E B2RXH2 2/20 0.44
PRKCZ Q05513 1/20 0.44
TNF P01375 1/20 0.44
POLB P06746 1/20 0.44
HTT P42858 1/20 0.44
RAD52 P43351 1/20 0.44
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL445029 0.97 CLK1 (0.52) CLK1CSNK1DCSNK1EDYRK1AHASPIN
Charcoal, Activated SCHEMBL30641848 0.95 CLK1 (0.50) CLK1CSNK1DCSNK1EDYRK1AHASPIN
SCHEMBL13156540 0.95 CLK1 (0.50) CLK1CSNK1DCSNK1EDYRK1AHASPIN
SCHEMBL1512981 0.95 CLK1 (0.50) CLK1CSNK1DCSNK1EDYRK1AHASPIN
Anthracene SCHEMBL29011110 0.90 CYP19A1 (0.50) CLK1CSNK1DCSNK1EDYRK1AHASPIN
SCHEMBL4036768 0.89 CLK1 (0.57) CLK1CSNK1DCSNK1EDYRK1AHASPIN
SCHEMBL445516 0.89 CLK1 (0.57) CLK1CSNK1DCSNK1EDYRK1AHASPIN
SCHEMBL13156508 0.87 CLK1 (0.55) CLK1CSNK1DCSNK1EDYRK1AHASPIN
SCHEMBL13156497 0.87 CLK1 (0.55) CLK1CSNK1DCSNK1EDYRK1AHASPIN
SCHEMBL13156496 0.87 CLK1 (0.55) CLK1CSNK1DCSNK1EDYRK1AHASPIN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116924986-B Nitrogen-containing heterocycle functional layer material, preparation method and application 山东千铄新材料有限公司 2024-04-09 CN disclosed
CN-116924986-A Nitrogen-containing heterocycle functional layer material, preparation method and application 山东千铄新材料有限公司 2023-10-24 CN disclosed