SCHEMBL9653285

SCHEMBL9653285

CCOC(=O)/C(C(=O)N(C)C)=C(/O)c1ccc(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43
KMT2A Q03164 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
RECQL P46063 1/20 0.41
ATM Q13315 1/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
HIF1A Q16665 1/20 0.40
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
KDM4E B2RXH2 2/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL9653220 1.00 MAPT (0.46) MAPTALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL9651887 0.99 ALDH1A1 (0.45) MAPTALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL9653233 0.85 SMN1; SMN2 (0.46) MAPTALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL9652682 0.85 ALDH1A1 (0.44) MAPTALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL9650657 0.84 SMN1; SMN2 (0.45) MAPTALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL9652724 0.83 ALDH1A1 (0.42) MAPTALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL9653251 0.83 ALDH1A1 (0.45) MAPTALDH1A1TDP1CYP3A4KMT2A
SCHEMBL9650733 0.82 TDP1 (0.43) MAPTALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL10656341 0.82 NPC1 (0.46) MAPTALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL9653773 0.81 MAPT (0.42) MAPTALDH1A1TDP1SMN1; SMN2KMT2A

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-0213892-B1 HERBICIDALLY ACTIVE ENOLS ROHM AND HAAS COMPANY (US) 1992-03-25 EP disclosed
US-4781750-A Herbicidally active enols ROHM AND HAAS COMPANY (US) 1988-11-01 US disclosed
EP-0213892-A2 Herbicidally active enols ROHM AND HAAS COMPANY (US) 1987-03-11 EP disclosed