SCHEMBL8308548

SCHEMBL8308548

COCCNC(=O)c1ccc(Cl)nn1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.54
ALDH1A1 P00352 3/20 0.54
TP53 P04637 1/20 0.48
RECQL P46063 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALPL P05186 1/20 0.45
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 2/20 0.44
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
JUN P05412 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
CYP1A2 P05177 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL938665 0.87 SCN9A (0.44) HPGDALDH1A1RAB9AKDM4EHTT
SCHEMBL8310937 0.84 NPC1 (0.47) HPGDALDH1A1TP53RECQLRAB9A
SCHEMBL8310344 0.83 JUN (0.48) HPGDALDH1A1ALPLKDM4EHTT
SCHEMBL936691 0.81 MAPT (0.62) HPGDRAB9ALMNA
SCHEMBL8311148 0.81 JUN (0.47) ALDH1A1KDM4EHSD17B10MAPK1JUN
SCHEMBL936146 0.81 JUN (0.47) LMNAJUNNFKB1NFKB2RELA
SCHEMBL20152022 0.80 JUN (0.48) HPGDKDM4EHSD17B10LMNAHTT
SCHEMBL937296 0.80 PANK3 (0.48) ALPLRAB9ALMNA
SCHEMBL937874 0.80 JUN (0.46) JUNNFKB1NFKB2RELA
SCHEMBL937430 0.80 NAAA (0.50) HPGDKDM4EHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0918769-A1 SUBSTITUTED PIPERAZINYL-PHENYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTI-BACTERIAL AGENTS AstraZeneca AB (SE) 1999-06-02 EP disclosed
EP-0904269-A1 3,4-DIARYL-2-HYDROXY-2,5-DIHYDROFURANS AS PRODRUGS TO COX-2 INHIBITORS MERCK FROSST CANADA INC. (CA) 1999-03-31 EP disclosed
WO-1998001446-A1 SUBSTITUTED PIPERAZINYL-PHENYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTI-BACTERIAL AGENTS ZENECA LIMITED (GB) 1998-01-15 WO disclosed
WO-1997016435-A1 3,4-DIARYL-2-HYDROXY-2,5-DIHYDROFURANS AS PRODRUGS TO COX-2 INHIBITORS MERCK FROSST CANADA INC. (CA) 1997-05-09 WO disclosed