SCHEMBL12461503

SCHEMBL12461503

N=C(N)c1ccc(OCCCCN)cc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 7/20 0.85
▸ PRMT1 Q99873 3/20 0.82
▸ F2 P00734 2/20 0.82
▸ ST14 Q9Y5Y6 2/20 0.82
▸ TMPRSS2 O15393 2/20 0.82
▸ PLAU P00749 1/20 0.82
▸ PRMT5 O14744 1/20 0.82
▸ SLC22A2 O15244 1/20 0.82
▸ SLC22A1 O15245 1/20 0.82
▸ PTP4A3 O75365 1/20 0.82
▸ SLC22A3 O75751 1/20 0.82
▸ F10 P00742 1/20 0.82
▸ PLG P00747 1/20 0.82
▸ S100B P04271 1/20 0.82
▸ CHRM2 P08172 1/20 0.82
▸ CHRM4 P08173 1/20 0.82
▸ CHRM5 P08912 1/20 0.82
▸ ADRA2A P08913 1/20 0.82
▸ CYP2D6 P10635 1/20 0.82
▸ AOC1 P19801 1/20 0.82

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
SCHEMBL12461521 0.98 PRMT1 (0.86) PRSS1PRMT1F2ST14TMPRSS2
SCHEMBL12460727 0.98 PRMT1 (0.86) PRSS1PRMT1F2ST14TMPRSS2
Hydrochloric Acid SCHEMBL1715174 0.98 PRSS1 (0.86) PRSS1PRMT1F2ST14TMPRSS2
Hydrochloric Acid SCHEMBL1715183 0.96 PRSS1 (0.86) PRSS1PRMT1F2ST14TMPRSS2
Hydrochloric Acid SCHEMBL1715428 0.96 PRSS1 (0.86) PRSS1PRMT1F2ST14TMPRSS2
SCHEMBL12460728 0.94 PRSS1 (0.81) PRSS1PRMT1F2ST14TMPRSS2
Hydrochloric Acid SCHEMBL1714481 0.93 PRSS1 (0.82) PRSS1PRMT1F2ST14TMPRSS2
SCHEMBL6408670 0.92 PRSS1 (1.00) PRSS1PRMT1F2ST14TMPRSS2
Heptamidine SCHEMBL14599630 0.90 PRMT1 (1.00) PRSS1PRMT1F2ST14TMPRSS2
Hexamidine SCHEMBL144738 0.90 PRMT1 (1.00) PRSS1PRMT1F2ST14TMPRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1481966-B1 NOVEL ARYLAMIDINE DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2011-07-20 — — EP disclosed
US-7291617-B2 Arylamidine derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2007-11-06 — — US disclosed
US-7291617-B2 Arylamidine derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2007-11-06 — — US disclosed
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