SCHEMBL9822943

SCHEMBL9822943

O=C1CNC(=O)N1c1cnc2ccccc2n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.45
RAB9A P51151 7/20 0.45
MAPT P10636 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 3/20 0.45
NFKB1 P19838 2/20 0.45
NFKB2 Q00653 2/20 0.45
RELA Q04206 2/20 0.45
HTR3A P46098 1/20 0.45
HRH4 Q9H3N8 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 3/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SORD Q00796 1/20 0.39
HCRTR2 O43614 5/20 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
SCHEMBL10372621 0.75 SMN1; SMN2 (0.55) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL28283926 0.69 HCRTR1 (0.49) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL9823405 0.69 NPC1 (0.45) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL8470425 0.68 P4HTM (0.37) ALDH1A1KDM4ELMNASORD
SCHEMBL28282293 0.68 NPC1 (0.64) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1979214 0.66 MEN1 (0.50) ALDH1A1GAAHPGDHTTNPSR1
SCHEMBL31184151 0.66 NPC1 (0.72) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL29832295 0.66 NPC1 (0.72) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL2114532 0.66 NPC1 (0.66) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL22144519 0.66 CRBN (0.49) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1

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 7 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 disclosed
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 disclosed
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
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
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