SCHEMBL9618809

SCHEMBL9618809

COC(=O)CO/N=C/c1c[c]ccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
LMNA P02545 3/20 0.35
PTGS2 P35354 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
MAPT P10636 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
HPGD P15428 3/20 0.33
KDM4E B2RXH2 2/20 0.33
TASP1 Q9H6P5 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL9618812 1.00 ALDH1A1 (0.38) ALDH1A1LMNAPTGS2KMT2AMEN1
SCHEMBL9619097 0.87 L3MBTL1 (0.41) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL9619093 0.87 L3MBTL1 (0.41) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL9618769 0.87 MAPT (0.35) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL9618876 0.86 ALDH1A1 (0.34) ALDH1A1KMT2AMEN1
SCHEMBL9618852 0.85 ALDH1A1 (0.34) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL9618856 0.85 ALDH1A1 (0.34) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL10551845 0.85 MAPT (0.41) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL9618931 0.83 L3MBTL1 (0.43) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL9618928 0.83 L3MBTL1 (0.43) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2

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-0236916-B1 N-ARYLTETRAHYDROPHTHALIMIDE DERIVATIVES AND THEIR PRECURSORS BASF Aktiengesellschaft (DE) 1992-01-08 EP disclosed
US-4844733-A PRE- AND POSTEMERGENCE BASF AKTIENGESELLSCHAFT (DE) 1989-07-04 US disclosed
EP-0236916-A2 N-aryltetrahydrophthalimide derivatives and their precursors BASF Aktiengesellschaft (DE) 1987-09-16 EP disclosed