SCHEMBL6940104

SCHEMBL6940104

CC(C)OC(=O)c1cc(-c2c(Br)c(C(F)(F)F)n(C)c2Br)c(F)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.32
PDK2 Q15119 1/20 0.32
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL6937354 0.88 GAA (0.38) LMNAMAPTHPGDSMN1; SMN2GAA
SCHEMBL6939212 0.85 BAZ2B (0.40) LMNAMAPTHPGDSMN1; SMN2GAA
SCHEMBL6937343 0.85 POLB (0.32) HPGDALDH1A1POLB
SCHEMBL6938081 0.82 ALDH1A1 (0.39) HPGDGAAPDK2ALDH1A1POLB
SCHEMBL38910 0.80 ALDH1A1 (0.33) LMNAMAPTHPGDSMN1; SMN2GAA
SCHEMBL30750946 0.80 ALDH1A1 (0.33) LMNAMAPTHPGDSMN1; SMN2GAA
SCHEMBL7561296 0.80 ALDH1A1 (0.33) LMNAMAPTHPGDSMN1; SMN2GAA
SCHEMBL6939220 0.79 HPGD (0.51) LMNAMAPTHPGDSMN1; SMN2GAA
SCHEMBL6935078 0.77 HSD11B1 (0.31)
SCHEMBL27320851 0.77 MAPT (0.34) LMNAMAPTHPGDSMN1; SMN2GAA

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-1061072-B1 Pyrrolic compounds with a high herbicidal activity and their agronomic use ISAGRO RICERCA SRL (IT) 2003-05-14 EP disclosed
US-6391827-B1 CONTROLLING WEEDS ISAGRO RICERCA S.R.L. (IT) 2002-05-21 US disclosed
EP-1061072-A1 Pyrrolic compounds with a high herbicidal activity and their agronomic use ISAGRO RICERCA S.r.l. (IT) 2000-12-20 EP disclosed