SCHEMBL9534208

SCHEMBL9534208

CCOC(=O)OC1CCCCN1C(=O)Cc1c(F)cccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
MEN1 O00255 3/20 0.60
GAA P10253 1/20 0.59
MAPT P10636 2/20 0.55
KDM4E B2RXH2 5/20 0.52
TSHR P16473 2/20 0.52
POLB P06746 1/20 0.52
ALDH1A1 P00352 6/20 0.51
TDP1 Q9NUW8 3/20 0.51
ALOX15 P16050 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL9538257 0.93 KMT2A (0.49) KMT2ASMN1; SMN2MEN1GAAMAPT
SCHEMBL9537713 0.86 KMT2A (0.55) KMT2ASMN1; SMN2MEN1GAAMAPT
SCHEMBL9536562 0.85 OPRK1 (0.44) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9727384 0.84 KMT2A (0.67) KMT2ASMN1; SMN2MEN1GAAMAPT
SCHEMBL9383304 0.83 KMT2A (0.54) KMT2ASMN1; SMN2MEN1GAAMAPT
SCHEMBL9535443 0.82 KMT2A (0.43) KMT2ASMN1; SMN2MEN1GAAMAPT
SCHEMBL9539327 0.82 OPRK1 (0.42) KMT2ASMN1; SMN2MEN1TSHRTDP1
SCHEMBL9538662 0.80 SMN1; SMN2 (0.41) KMT2ASMN1; SMN2MEN1GAAALDH1A1
SCHEMBL9539291 0.80 KMT2A (0.44) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL8315952 0.79 KMT2A (0.47) KMT2ASMN1; SMN2MEN1GAAMAPT

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-0355599-B1 3-ARYL-PYRROLIDINE-2,4-DIONES BAYER AG (DE) 1993-05-19 EP disclosed
EP-0355599-A1 3-Aryl-pyrrolidine-2,4-diones BAYER AG (DE) 1990-02-28 EP disclosed