SCHEMBL11162983

SCHEMBL11162983

NS(=O)(=O)c1ccc(Oc2ccccc2NC(=S)NC(=O)c2ccccc2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 5/20 0.53
▸ EPHX1 P07099 4/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ ALOX12 P18054 2/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ F10 P00742 1/20 0.47
▸ PLG P00747 1/20 0.47
▸ PLAT P00750 1/20 0.47
▸ KLK1 P06870 1/20 0.47
▸ PRSS1 P07477 1/20 0.47
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ CA9 Q16790 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47

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
SCHEMBL11167226 0.86 EPHX1 (0.59) EPHX1ALDH1A1ALOX12CYP2C9CYP2C19
SCHEMBL11160273 0.85 F10 (0.44) ALDH1A1ALOX12CYP2C19NPSR1F10
SCHEMBL11439725 0.81 ALDH1A1 (0.71) EPHX1ALDH1A1ALOX12CYP2C9CYP2C19
SCHEMBL11166506 0.80 ALDH1A1 (0.62) EPHX1ALDH1A1ALOX12CYP2C9CYP2C19
SCHEMBL11162731 0.80 EPHX1 (0.58) EPHX1ALDH1A1ALOX12CYP2C9CYP2C19
SCHEMBL11105097 0.79 EPHX1 (0.66) EPHX1ALDH1A1ALOX12CYP2C9CYP2C19
SCHEMBL11165536 0.77 EPHX1 (0.60) EPHX1ALDH1A1ALOX12CYP2C9CYP2C19
SCHEMBL11170401 0.76 EPHX1 (0.61) EPHX1ALDH1A1ALOX12CYP2C9CYP2C19
SCHEMBL11168169 0.76 EPHX1 (0.65) EPHX1ALDH1A1ALOX12CYP2C9CYP2C19
SCHEMBL11161435 0.76 EPHX1 (0.56) EPHX1ALDH1A1ALOX12NPSR1MEN1

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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