SCHEMBL9343030

SCHEMBL9343030

FC(F)(F)c1cccc(-c2csc(-c3ccc[nH]3)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ ADAM17 P78536 1/20 0.49
▸ AR P10275 1/20 0.49
▸ EIF4E P06730 1/20 0.48
▸ CFTR P13569 2/20 0.46
▸ LTA4H P09960 1/20 0.45
▸ CASP3 P42574 1/20 0.45
▸ CASP7 P55210 1/20 0.45
▸ CASP8 Q14790 1/20 0.45
▸ IDO1 P14902 1/20 0.45
▸ HSD17B1 P14061 1/20 0.43
▸ HSD17B2 P37059 1/20 0.43
▸ XDH P47989 1/20 0.43
▸ CTSS P25774 1/20 0.43
▸ VCP P55072 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
SCHEMBL8799272 0.86 KDM4E (0.54) ALDH1A1MEN1KMT2AKDM4EAR
SCHEMBL28743338 0.84 ALDH1A1 (0.71) ALDH1A1MEN1KMT2AKDM4EADAM17
SCHEMBL8798823 0.80 KDM4E (0.56) ALDH1A1MEN1KMT2AKDM4EAR
SCHEMBL17014793 0.80 KDM4E (0.69) ALDH1A1MEN1KMT2AKDM4EADAM17
SCHEMBL30279814 0.78 KMT2A (0.67) ALDH1A1MEN1KMT2AKDM4EAR
SCHEMBL21479644 0.78 KMT2A (0.67) ALDH1A1MEN1KMT2AKDM4EAR
SCHEMBL694985 0.77 ALDH1A1 (0.66) ALDH1A1MEN1KMT2AKDM4EADAM17
SCHEMBL1198896 0.76 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AKDM4EADAM17
SCHEMBL474410 0.76 LTA4H (0.67) ALDH1A1MEN1KMT2AKDM4EADAM17
SCHEMBL8183810 0.75 KDM4E (0.62) ALDH1A1MEN1KMT2AKDM4EAR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5334605-A Agricultural uses MINISTERO DELL'UNIVERSITA' E DELLA RICERCA SCIENTIFICA E (IT) 1994-08-02 — — US disclosed
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