SCHEMBL9820082

SCHEMBL9820082

Cc1cccc2nc3ccc(=O)c(OC(=O)O)c-3oc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.35
FAAH O00519 1/20 0.35
CETP P11597 1/20 0.35
MAOB P27338 1/20 0.34
ELANE P08246 3/20 0.33
PTGER4 P35408 1/20 0.33
AR P10275 1/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPK1 P28482 2/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 2/20 0.33
PKM P14618 2/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 1/20 0.33
USP2 O75604 1/20 0.33
TSHR P16473 1/20 0.33
PLIN1 O60240 1/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
PLIN5 Q00G26 1/20 0.33

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
SCHEMBL9295721 0.81 MCL1 (0.40) MCL1FAAHCETPMAOBELANE
SCHEMBL9819945 0.80 MEN1 (0.41) ELANEALDH1A1KDM4EPOLBPKM
SCHEMBL9819998 0.76 GAA (0.44) MAOBALDH1A1MAPK1KDM4EPOLB
SCHEMBL9836825 0.75 AKR1B1 (0.39) CETPALDH1A1KDM4EPOLBHPGD
SCHEMBL9835193 0.71 GAA (0.45) ELANEALDH1A1KDM4EPOLBHPGD
SCHEMBL9820046 0.71 GRIN1 (0.36) MCL1CETPALDH1A1KDM4EPOLB
SCHEMBL9819961 0.71 GAA (0.43) CETPALDH1A1MAPK1KDM4EPOLB
SCHEMBL10351910 0.66 RAB9A (0.34) ELANEALDH1A1KDM4EPOLBLMNA
SCHEMBL9819887 0.66 MAPT (0.41) ELANEALDH1A1MAPK1KDM4EPOLB
SCHEMBL28681416 0.65 KDM4E (0.39) MAOBELANEALDH1A1KDM4EPOLB

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
EP-0210559-B1 N-ACYLDIHYDRORESORUFIN DERIVATIVES, PROCESS FOR THEIR PREPARATION AS WELL AS THEIR USE FOR THE DETERMINATION OF HYDROGEN PEROXIDE, PEROXIDATICALLY ACTIVE COMPOUNDS, OR PEROXIDASE Roche Diagnostics GmbH (DE) 1991-09-25 EP disclosed
EP-0156347-B1 GLYCOSIDES OF RESOFURIN DERIVATIVES, METHOD FOR THEIR PREPARATION AND THEIR USE IN THE DETERMINATION OF THE ACTIVITY OF GLYCOSIDASES Roche Diagnostics GmbH (DE) 1991-09-04 EP disclosed
EP-0210559-A2 N-Acyldihydroresorufin derivatives, process for their preparation as well as their use for the determination of hydrogen peroxide, peroxidatically active compounds, or peroxidase Roche Diagnostics GmbH (DE) 1987-02-04 EP disclosed