SCHEMBL7342376

SCHEMBL7342376

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

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F12 P00748 11/20 0.71
PRSS1 P07477 5/20 0.71
F2 P00734 5/20 0.71
F10 P00742 3/20 0.71
MAPT P10636 2/20 0.71
HGFAC Q04756 2/20 0.71
C1R P00736 2/20 0.71
PLG P00747 2/20 0.71
KLK1 P06870 2/20 0.71
TMPRSS2 O15393 1/20 0.71
MLNR O43193 1/20 0.71
ALDH1A1 P00352 1/20 0.71
LMNA P02545 1/20 0.71
ITGB3 P05106 1/20 0.71
HPN P05981 1/20 0.71
CHRM2 P08172 1/20 0.71
ITGA2B P08514 1/20 0.71
C1S P09871 1/20 0.71
ADORA3 P0DMS8 1/20 0.71
CHRM1 P11229 1/20 0.71

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
SCHEMBL31380450 0.92 F12 (0.76) F12PRSS1F2F10MAPT
SCHEMBL7340875 0.92 FTO (0.74) F12PRSS1F2F10MAPT
SCHEMBL7338848 0.88 F12 (0.71) F12PRSS1F2F10MAPT
SCHEMBL7337750 0.88 F12 (0.71) F12PRSS1F2F10MAPT
SCHEMBL9342118 0.85 PRSS1 (0.64) F12PRSS1F2F10MAPT
SCHEMBL13292773 0.85 KMT2A (0.64) F12PRSS1F2F10MAPT
SCHEMBL6052916 0.84 KMT2A (0.58) F12PRSS1F2F10MAPT
SCHEMBL7340925 0.84 F12 (0.66) F12PRSS1F2F10MAPT
Hydrochloric Acid SCHEMBL10941768 0.84 PRSS1 (0.62) F12PRSS1F2F10MAPT
SCHEMBL4132832 0.83 KMT2A (0.57) F12PRSS1F2F10MAPT

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
EP-0048433-B1 NOVEL AMIDINE COMPOUNDS, PROCESS FOR PRODUCING SAME AND ANTI-COMPLEMENT AGENT COMPRISING THEM TORII & CO., LTD. (JP) 1986-05-28 EP disclosed
US-4532255-A Amidine compounds and anticomplement agent comprising same TORII & CO., LTD. (JP) 1985-07-30 US disclosed
US-4454338-A 6-AMIDINO-2-NATHTHYL-4-GUANIDINOBENZOATE TORII & CO., LTD. (JP) 1984-06-12 US disclosed
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