SCHEMBL8316443

SCHEMBL8316443

CCOC(=O)OC1C(C)CCN1C(=O)Cc1c(Cl)cccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 2/20 0.48
DRD1 P21728 1/20 0.47
GAA P10253 2/20 0.45
KDM4E B2RXH2 6/20 0.43
ALDH1A1 P00352 6/20 0.43
TDP1 Q9NUW8 4/20 0.43
TSHR P16473 3/20 0.43
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.40
ALOX15 P16050 1/20 0.39
SIGMAR1 Q99720 2/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL8317105 0.94 KMT2A (0.48) KMT2ASMN1; SMN2MEN1DRD1GAA
SCHEMBL8316844 0.89 KMT2A (0.37) KMT2ASMN1; SMN2MEN1DRD1GAA
SCHEMBL8317229 0.89 KMT2A (0.38) KMT2ASMN1; SMN2MEN1DRD1GAA
SCHEMBL8315832 0.83 KMT2A (0.38) KMT2ASMN1; SMN2MEN1DRD1GAA
SCHEMBL8315952 0.83 KMT2A (0.47) KMT2ASMN1; SMN2MEN1DRD1GAA
SCHEMBL8315440 0.82 KMT2A (0.39) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL8877073 0.82 KMT2A (0.55) KMT2ASMN1; SMN2MEN1DRD1GAA
SCHEMBL8313613 0.82 MEN1 (0.36) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL8316830 0.82 KMT2A (0.43) KMT2ASMN1; SMN2MEN1ALDH1A1TSHR
SCHEMBL9538257 0.81 KMT2A (0.49) KMT2ASMN1; SMN2MEN1DRD1GAA

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-0501129-B1 Substituted bicyclic 3-arylpyrrolidin-2,4-dion derivatives BAYER AG (DE) 1999-07-14 EP disclosed
EP-0501129-A1 Substituted bicyclic 3-arylpyrrolidin-2,4-dion derivatives BAYER AG (DE) 1992-09-02 EP disclosed