SCHEMBL7693149

SCHEMBL7693149

Cn1c(Cl)c(-c2cc(OCC(=O)N3CCOCC3)c(Cl)cc2F)c(Cl)c1C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 7/20 0.53
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
GAA P10253 2/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 2/20 0.40
GLA P06280 1/20 0.40
PDK2 Q15119 1/20 0.39
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL7694241 0.92 HTT (0.46) FKBP1AMEN1KMT2ASMN1; SMN2GAA
SCHEMBL7690094 0.91 HPGD (0.47) FKBP1AMEN1KMT2ASMN1; SMN2GAA
SCHEMBL7694736 0.89 FKBP1A (0.52) FKBP1AMEN1KMT2ASMN1; SMN2GAA
SCHEMBL7693094 0.83 LMNA (0.33) MEN1KMT2ATSHR
SCHEMBL6937330 0.83 PTGDR2 (0.39) TSHRALDH1A1KDM4EHSD17B10
SCHEMBL6934937 0.83 LMNA (0.33) MEN1KMT2ATSHR
SCHEMBL6935030 0.82 PTGDR2 (0.34) MEN1KMT2A
SCHEMBL6937105 0.81 KDM4E (0.36) MEN1KMT2ASMN1; SMN2GAATSHR
SCHEMBL7693942 0.81 HTT (0.44) FKBP1AMEN1KMT2ASMN1; SMN2GAA
SCHEMBL6935585 0.80 PPOX (0.46) MEN1KMT2AGAATSHRALDH1A1

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