SCHEMBL11166459

SCHEMBL11166459

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.50
▸ NPSR1 Q6W5P4 3/20 0.50
▸ ALOX12 P18054 2/20 0.50
▸ GPR55 Q9Y2T6 1/20 0.50
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP3A5 P20815 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ HTR2A P28223 5/20 0.48
▸ SLC6A4 P31645 5/20 0.48
▸ KCNH2 Q12809 5/20 0.48
▸ MAPT P10636 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL11158176 0.84 NPSR1 (0.57) ALDH1A1NPSR1ALOX12GPR55CYP3A4
SCHEMBL11160273 0.83 F10 (0.44) ALDH1A1NPSR1ALOX12GPR55CYP3A4
SCHEMBL11166925 0.83 NPSR1 (0.62) ALDH1A1NPSR1ALOX12GPR55SLC6A4
SCHEMBL11158092 0.82 ALDH1A1 (0.52) ALDH1A1NPSR1ALOX12GPR55CYP3A4
SCHEMBL11159755 0.80 ALDH1A1 (0.51) ALDH1A1NPSR1ALOX12GPR55CYP3A4
SCHEMBL11167226 0.80 EPHX1 (0.59) ALDH1A1NPSR1ALOX12GPR55CYP2C19
SCHEMBL7815135 0.80 ADRA2C (0.59) ALDH1A1NPSR1ALOX12GPR55MAPT
SCHEMBL11160995 0.79 CACNA1H (0.49) ALDH1A1NPSR1ALOX12GPR55CYP3A4
SCHEMBL11163188 0.78 L3MBTL1 (0.53) ALDH1A1NPSR1ALOX12GPR55CYP3A4
SCHEMBL11164283 0.78 ADRA2C (0.47) ALDH1A1NPSR1ALOX12GPR55CYP3A4

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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