SCHEMBL9622353

SCHEMBL9622353

CCCOC(=O)c1c(Cl)cccc1Oc1nc(OC)cc(OC)n1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.58
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CYP1A2 P05177 3/20 0.51
CYP2C9 P11712 3/20 0.51
CYP2C19 P33261 3/20 0.51
ATM Q13315 1/20 0.51
CYP3A4 P08684 2/20 0.47
GAA P10253 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
SCHEMBL9623014 0.93 NPSR1 (0.56) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9622245 0.91 NPSR1 (0.58) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9379389 0.87 NPSR1 (0.57) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9045943 0.86 NPSR1 (0.62) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9214711 0.85 NPSR1 (0.55) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9622238 0.85 NPSR1 (0.55) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9220565 0.85 NPSR1 (0.53) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9221014 0.84 NPSR1 (0.54) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9622229 0.84 NPSR1 (0.56) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL9217757 0.84 NPSR1 (0.54) NPSR1ALDH1A1SMN1; SMN2CYP1A2CYP2C9

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-0249708-B1 2-PHENOXYPYRIMIDINE DERIVATIVE AND HERBICIDAL COMPOSITIONS KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1992-03-11 EP claimed
US-4900352-A 2-Phenoxypyimidine derivative and herbicidal composition KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-02-13 US claimed
EP-0249708-A1 2-Phenoxypyrimidine derivative and herbicidal compositions KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1987-12-23 EP claimed