SCHEMBL7703288

SCHEMBL7703288

CC(=O)Oc1cc(-c2c(Cl)c(C(F)(F)F)n(C)c2Cl)c(F)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.35
KDM4E B2RXH2 3/20 0.32
GLA P06280 2/20 0.32
GAA P10253 2/20 0.32
GFER P55789 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 2/20 0.32
USP2 O75604 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
TNFSF11 O14788 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
KMT2A Q03164 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
SCHEMBL6935033 0.91
SCHEMBL6934937 0.85 LMNA (0.33) CYP2C19MEN1LMNAKMT2A
SCHEMBL7725259 0.85 BACE1 (0.33) BACE1KDM4EGLAGAAGFER
SCHEMBL6937330 0.83 PTGDR2 (0.39) KDM4EALDH1A1HSD17B10HPGDCYP2C19
SCHEMBL7693094 0.83 LMNA (0.33) CYP2C19MEN1LMNAKMT2A
SCHEMBL7693700 0.83
SCHEMBL6937575 0.82 PTGDR2 (0.39) KDM4EALDH1A1HSD17B10HPGD
SCHEMBL6935030 0.81 PTGDR2 (0.34) CYP2C19MEN1LMNAKMT2A
SCHEMBL6938757 0.81 CNR2 (0.32) KDM4EALDH1A1HSD17B10USP2MEN1
SCHEMBL6937717 0.81 PPOX (0.35) GAAMEN1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002070476-A1 PHENYLPYRROLES WITH A HERBICIDAL ACTIVITY ISAGRO RICERCA S.R.L. (IT) 2002-09-12 WO claimed
WO-2002070476-A1 PHENYLPYRROLES WITH A HERBICIDAL ACTIVITY ISAGRO RICERCA S.R.L. (IT) 2002-09-12 WO disclosed