SCHEMBL9028816

SCHEMBL9028816

FC(F)(F)c1cccc(-c2nsc(Cl)n2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.52
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HSD17B10 Q99714 2/20 0.48
MEN1 O00255 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
THRB P10828 1/20 0.48
CYP2C9 P11712 1/20 0.48
PKM P14618 1/20 0.48
TSHR P16473 1/20 0.48
STAT6 P42226 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
HIF1A Q16665 1/20 0.48

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
SCHEMBL8591762 0.83 S1PR1 (0.40) CASP3RAB9ANPC1NPSR1KDM4E
SCHEMBL20320387 0.81 ALDH1A1 (0.46) CASP3RAB9ANPC1NPSR1KDM4E
SCHEMBL8805612 0.81 IDO1 (0.44) CASP3RAB9ANPC1NPSR1KDM4E
SCHEMBL28645827 0.81 CASP3 (0.43) CASP3RAB9ANPC1NPSR1KDM4E
SCHEMBL3765784 0.80 CASP3 (0.48) CASP3THRBS1PR1
SCHEMBL3769512 0.79 KDM4E (0.42) KDM4EALDH1A1MEN1KMT2AIDO1
SCHEMBL14488183 0.78 CYP19A1 (0.46) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL8709756 0.78 GRM5 (0.46) S1PR1DYRK1AHDAC1HDAC6CTSS
SCHEMBL28402665 0.77 HSD17B1 (0.53) RAB9ANPC1NPSR1KDM4EALDH1A1
SCHEMBL14755837 0.76 ALDH1A1 (0.51) CASP3RAB9ANPC1ALDH1A1HPGD

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-0667865-B1 OXA- AND THIADIAZOLE DERIVATIVES USED AS INSECTICIDES AND FUNGICIDES ZENECA LTD (GB) 1996-12-11 EP disclosed
US-5438066-A Fungicide, insecticide, miticide and pesticide ZENECA LIMITED (GB) 1995-08-01 US disclosed
WO-1994010159-A1 OXA- AND THIADIAZOLE DERIVATIVES USED AS INSECTICIDES AND FUNGICIDES ZENECA LIMITED (GB) 1994-05-11 WO disclosed