SCHEMBL9217488

SCHEMBL9217488

CCOC(=O)C(=N\Nc1c(Cl)cc(C(F)(F)F)cc1Cl)/C(C)=N/O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.60
GPR35 Q9HC97 1/20 0.46
MAPT P10636 4/20 0.45
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.41
GAA P10253 4/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALOX12 P18054 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35

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
SCHEMBL9217495 1.00 ABCB1 (0.60) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9218647 0.90 ABCB1 (0.64) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9218656 0.90 ABCB1 (0.64) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9218156 0.88 ABCB1 (0.57) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9218150 0.88 ABCB1 (0.57) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9215583 0.86 ABCB1 (0.63) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9215587 0.86 ABCB1 (0.63) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9215612 0.85 ABCB1 (0.56) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9215605 0.85 ABCB1 (0.56) ABCB1GPR35MAPTL3MBTL1ALDH1A1
SCHEMBL9216170 0.85 ABCB1 (0.56) ABCB1GPR35MAPTL3MBTL1ALDH1A1

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-0412849-B1 Azole pesticides AGREVO UK LTD (GB) 1995-12-20 EP disclosed
US-5189053-A Insecticide, acaricide and endoparasiticide SCHERING AGROCHEMICALS LIMITED (GB) 1993-02-23 US disclosed
US-5109012-A 2-IMIDAZOL(IN)E SUBSTITUTED ARYL-1,2,3-TRIAZOLE PESTICIDES SCHERING AGROCHEMICALS LIMITED (GB) 1992-04-28 US disclosed