SCHEMBL8315952

SCHEMBL8315952

CCOC(=O)OC1CC(C)CCN1C(=O)Cc1c(Cl)cccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 2/20 0.47
GAA P10253 1/20 0.46
DRD1 P21728 1/20 0.46
ALDH1A1 P00352 7/20 0.44
KDM4E B2RXH2 5/20 0.44
TDP1 Q9NUW8 3/20 0.44
TSHR P16473 2/20 0.41
POLB P06746 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
OPRK1 P41145 3/20 0.39
OPRM1 P35372 1/20 0.39
ALOX15 P16050 1/20 0.38
MAPT P10636 1/20 0.38
CASP1 P29466 1/20 0.36
HTT P42858 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
SCHEMBL8310881 0.89 ALDH1A1 (0.39) KMT2ASMN1; SMN2MEN1GAADRD1
SCHEMBL8314379 0.89 DRD1 (0.45) KMT2ASMN1; SMN2MEN1GAADRD1
SCHEMBL8313446 0.89 KMT2A (0.37) KMT2ASMN1; SMN2MEN1GAADRD1
SCHEMBL9538257 0.86 KMT2A (0.49) KMT2ASMN1; SMN2MEN1GAADRD1
SCHEMBL8314625 0.84 KMT2A (0.45) KMT2ASMN1; SMN2MEN1GAADRD1
SCHEMBL8314818 0.83 KMT2A (0.37) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL8875071 0.83 SMN1; SMN2 (0.53) KMT2ASMN1; SMN2MEN1GAADRD1
SCHEMBL8315579 0.83 KMT2A (0.43) KMT2ASMN1; SMN2MEN1GAADRD1
SCHEMBL8316443 0.83 KMT2A (0.48) KMT2ASMN1; SMN2MEN1GAADRD1
SCHEMBL8317694 0.82 KMT2A (0.43) KMT2ASMN1; SMN2MEN1ALDH1A1TSHR

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