Methane

Methane

SCHEMBL11282601

C.N=C(N)c1ccc2cc(OC(=O)c3ccc(OCc4ccccc4)cc3)ccc2c1

nearest known ligand 0.58

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 7/20 0.58
PRSS1 P07477 3/20 0.58
F12 P00748 3/20 0.58
F10 P00742 2/20 0.58
ST14 Q9Y5Y6 2/20 0.58
MAPT P10636 2/20 0.58
TMPRSS2 O15393 1/20 0.58
MLNR O43193 1/20 0.58
ALDH1A1 P00352 1/20 0.58
C1R P00736 1/20 0.58
PLG P00747 1/20 0.58
LMNA P02545 1/20 0.58
ITGB3 P05106 1/20 0.58
HPN P05981 1/20 0.58
KLK1 P06870 1/20 0.58
CHRM2 P08172 1/20 0.58
ITGA2B P08514 1/20 0.58
C1S P09871 1/20 0.58
ADORA3 P0DMS8 1/20 0.58
CHRM1 P11229 1/20 0.58

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
SCHEMBL7343610 0.92 FTO (0.64) F2PRSS1F12F10ST14
SCHEMBL8756332 0.86 MAPT (0.60) MAPTALDH1A1LMNASLC6A3PARP10
SCHEMBL7337750 0.86 F12 (0.71) F2PRSS1F12F10ST14
SCHEMBL19430636 0.86 F2 (0.74) F2PRSS1F10ST14PLAU
Hydrochloric Acid SCHEMBL7830226 0.85 F2 (0.76) F2PRSS1F10ST14PLAU
SCHEMBL31380450 0.82 F12 (0.76) F2PRSS1F12F10ST14
SCHEMBL7345716 0.82 PLAU (0.53) F2PRSS1F12F10ST14
SCHEMBL7338848 0.81 F12 (0.71) F2PRSS1F12F10ST14
SCHEMBL7343617 0.80 PLAU (0.50) F2PRSS1F10ST14ITGB3
SCHEMBL20008714 0.80 PRSS1 (0.63) F2PRSS1F12F10ST14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0048433-A2 Novel amidine compounds, process for producing same and anti-complement agent comprising them TORII & CO., LTD. (JP) 1982-03-31 EP disclosed