SCHEMBL9618928

SCHEMBL9618928

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.43
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
HPGD P15428 2/20 0.36
RAB9A P51151 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
ESR1 P03372 1/20 0.34
CNR1 P21554 1/20 0.34
FAAH O00519 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33
EPHX2 P34913 1/20 0.32
APP P05067 1/20 0.32

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
SCHEMBL9618931 1.00 L3MBTL1 (0.43) L3MBTL1ALDH1A1TDP1SMN1; SMN2NPC1
SCHEMBL9618903 0.96 ALDH1A1 (0.39) L3MBTL1ALDH1A1TDP1FAAHTSHR
SCHEMBL9618852 0.93 ALDH1A1 (0.34) L3MBTL1ALDH1A1TDP1SMN1; SMN2HPGD
SCHEMBL9618856 0.93 ALDH1A1 (0.34) L3MBTL1ALDH1A1TDP1SMN1; SMN2HPGD
SCHEMBL9618983 0.90 ALDH1A1 (0.37) L3MBTL1ALDH1A1TDP1SMN1; SMN2NPC1
SCHEMBL9619093 0.88 L3MBTL1 (0.41) L3MBTL1ALDH1A1SMN1; SMN2NPC1HPGD
SCHEMBL9619097 0.88 L3MBTL1 (0.41) L3MBTL1ALDH1A1SMN1; SMN2NPC1HPGD
SCHEMBL9618934 0.86 EPHX2 (0.37) L3MBTL1ALDH1A1TDP1TSHREPHX2
SCHEMBL9618809 0.83 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2HPGDMAPTMEN1
SCHEMBL9618812 0.83 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2HPGDMAPTMEN1

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