SCHEMBL9822927

SCHEMBL9822927

O=C1NC(=O)C(c2cnc3ccccc3n2)N1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
KDM4E B2RXH2 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALOX15 P16050 2/20 0.46
GAA P10253 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
PDE10A Q9Y233 1/20 0.40
HTT P42858 4/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PIM1 P11309 1/20 0.38
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 1/20 0.37
ADORA3 P0DMS8 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
SCHEMBL2563428 0.73 DDB1 (0.51) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL23745244 0.73 DDB1 (0.51) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL20342557 0.69 HDAC4 (0.48) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14938938 0.67 NPC1 (0.62) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14467140 0.67 TDP1 (0.40) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL14466510 0.67 KDM4E (0.43) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL395878 0.66 TDP1 (0.66) MAPTKDM4EGAAHTTPOLB
SCHEMBL31738422 0.66 TDP1 (0.66) MAPTKDM4EGAAHTTPOLB
SCHEMBL19955179 0.66 TDP1 (0.66) MAPTKDM4EGAAHTTPOLB
SCHEMBL28695999 0.66 HDAC4 (0.43) MAPTKDM4ENPC1RAB9ASMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0288898-B1 SUBSTITUTED CHINOXALYL-IMIDAZOLIDINE-2,4-DIONES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND PHARMACOLOGICAL PREPARATIONS HOECHST AKTIENGESELLSCHAFT (DE) 1991-08-14 EP claimed
US-4943576-A ENZYME INHIBITORS HOECHST AKTIENGESELLSCHAFT (DE) 1990-07-24 US claimed
US-4943576-A ENZYME INHIBITORS HOECHST AKTIENGESELLSCHAFT (DE) 1990-07-24 US disclosed
US-4943576-A ENZYME INHIBITORS HOECHST AKTIENGESELLSCHAFT (DE) 1990-07-24 US disclosed
EP-0288898-A1 Substituted chinoxalyl-imidazolidine-2,4-diones, process for their preparation, their use as medicaments and pharmacological preparations HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-02 EP disclosed