SCHEMBL9280481

SCHEMBL9280481

C=CCc1ccc(CC=C)c2ncccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.47
L3MBTL1 Q9Y468 5/20 0.47
NPC1 O15118 3/20 0.47
HTT P42858 3/20 0.47
LMNA P02545 3/20 0.47
RAB9A P51151 2/20 0.47
GAA P10253 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALOX12 P18054 3/20 0.41
PAX8 Q06710 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSP90AA1 P07900 1/20 0.39
BRD4 O60885 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 2/20 0.39
ALOX15 P16050 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 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
SCHEMBL6892279 0.86 KDM4E (0.68) KDM4EL3MBTL1NPC1HTTLMNA
SCHEMBL6280397 0.86 MEN1 (0.54) KDM4EL3MBTL1NPC1HTTLMNA
SCHEMBL31106423 0.86 KDM4E (0.68) KDM4EL3MBTL1NPC1HTTLMNA
SCHEMBL11190488 0.78 CDK1 (0.46) KDM4EL3MBTL1NPC1HTTLMNA
SCHEMBL12533508 0.78 CCR1 (0.53) KDM4EL3MBTL1HTTLMNAGAA
SCHEMBL9276577 0.78 GABRA1 (0.39) KDM4EL3MBTL1NPC1HTTLMNA
SCHEMBL17926740 0.78 KDM4E (0.51) KDM4EL3MBTL1NPC1HTTLMNA
SCHEMBL431328 0.78 MAPT (0.48) KDM4EL3MBTL1HTTLMNARAB9A
SCHEMBL11846271 0.77 L3MBTL1 (0.47) KDM4EL3MBTL1NPC1HTTLMNA
SCHEMBL6896595 0.76 KDM4E (0.68) KDM4EL3MBTL1NPC1HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5585491-A Antibacterial agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-12-17 US disclosed
US-4920120-A 3-CARBOXY, 4-OXO, 6-FLUORO, 7-NITROGEN-CONTAINING RING 1,4-DIHYDRO-1,8-NAPHTHYRIDINES WARNER-LAMBERT COMPANY (US) 1990-04-24 US disclosed
EP-0326891-A2 Antibacterial agents WARNER-LAMBERT COMPANY (US) 1989-08-09 EP disclosed