SCHEMBL11160273

SCHEMBL11160273

NC(=S)Nc1ccccc1Oc1ccc(S(N)(=O)=O)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 3/20 0.44
▸ PLG P00747 1/20 0.44
▸ PLAT P00750 1/20 0.44
▸ KLK1 P06870 1/20 0.44
▸ PRSS1 P07477 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ NPSR1 Q6W5P4 3/20 0.44
▸ ALOX12 P18054 2/20 0.44
▸ GPR55 Q9Y2T6 1/20 0.44
▸ PTGDR2 Q9Y5Y4 1/20 0.41
▸ CA12 O43570 3/20 0.41
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ CA9 Q16790 3/20 0.41
▸ ACLY P53396 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PTGES2 Q9H7Z7 2/20 0.39
▸ P2RX4 Q99571 3/20 0.39

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
SCHEMBL11162983 0.85 PLK1 (0.53) F10PLGPLATKLK1PRSS1
SCHEMBL11166459 0.83 ALDH1A1 (0.50) ALDH1A1NPSR1ALOX12GPR55MEN1
SCHEMBL11171128 0.82 F10 (0.43) F10PLGPLATKLK1PRSS1
SCHEMBL11158176 0.76 NPSR1 (0.57) ALDH1A1NPSR1ALOX12GPR55MEN1
SCHEMBL11166925 0.76 NPSR1 (0.62) ALDH1A1NPSR1ALOX12GPR55MEN1
SCHEMBL11158092 0.75 ALDH1A1 (0.52) ALDH1A1NPSR1ALOX12GPR55ACLY
SCHEMBL11159755 0.73 ALDH1A1 (0.51) ALDH1A1NPSR1ALOX12GPR55MEN1
SCHEMBL7815135 0.73 ADRA2C (0.59) ALDH1A1NPSR1ALOX12GPR55CA12
SCHEMBL11153739 0.73 ADRA2A (0.42) NPSR1MEN1KMT2ACYP2D6CYP2C19
SCHEMBL11160995 0.72 CACNA1H (0.49) ALDH1A1NPSR1ALOX12GPR55MEN1

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
EP-0017484-B1 2-IMIDAZOLINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THE PHARMACEUTICAL COMPOSITION OF THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-04-06 — — EP disclosed
EP-0017484-A1 2-Imidazoline derivatives, process for the preparation thereof and the pharmaceutical composition of the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-10-15 — — EP disclosed
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