SCHEMBL20198170

SCHEMBL20198170

N=C/C(Cl)=C\Nc1cc(Cl)ccc1C=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
ERN1 O75460 4/20 0.41
ALDH1A1 P00352 4/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 2/20 0.32
KDM4E B2RXH2 2/20 0.31
KCNMA1 Q12791 2/20 0.31
PTPN1 P18031 1/20 0.31
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GRIK1 P39086 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SRC P12931 1/20 0.30

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
SCHEMBL5218972 0.77 TDP1 (0.55) TDP1ERN1ALDH1A1MAPTHPGD
SCHEMBL20198141 0.75 TDP1 (0.46) TDP1ERN1ALDH1A1MAPTMEN1
SCHEMBL28299606 0.70 TDP1 (0.55) TDP1ERN1ALDH1A1MAPTHPGD
SCHEMBL9753459 0.69 TDP1 (0.50) TDP1ERN1ALDH1A1MEN1KMT2A
SCHEMBL2212088 0.65 KMT2A (0.52) TDP1ERN1ALDH1A1MAPTHPGD
SCHEMBL4357334 0.64 TDP1 (0.70) TDP1ERN1ALDH1A1MAPTHPGD
SCHEMBL1019524 0.63 ERN1 (0.69) TDP1ERN1ALDH1A1
SCHEMBL29062573 0.63 ERN1 (0.52) TDP1ERN1ALDH1A1HPGDKDM4E
SCHEMBL13810126 0.63 ERN1 (0.57) TDP1ERN1ALDH1A1KDM4EPTPN1
SCHEMBL14611052 0.62 CCR2 (0.59) ALDH1A1

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
EP-3698782-A1 CARBAMATE COMPOUNDS FOR USE IN THERAPY Lundbeck La Jolla Research Center, Inc. (US) 2020-08-26 EP disclosed
EP-3326627-A1 CARBAMATE COMPOUNDS AND OF MAKING AND USING SAME Abide Therapeutics, Inc. (US) 2018-05-30 EP disclosed