SCHEMBL8089352

SCHEMBL8089352

CCOC(=O)c1[nH]c2c(c1C)/C(=N\O)C(Cc1ccc(Cl)c(Cl)c1)CC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 5/20 0.38
POLB P06746 2/20 0.38
TSHR P16473 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
MAPT P10636 2/20 0.37
ALOX15 P16050 2/20 0.37
HTT P42858 2/20 0.37
MAPK1 P28482 1/20 0.37
MEN1 O00255 1/20 0.37
ESR1 P03372 1/20 0.37
PKM P14618 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
MCL1 Q07820 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL8081420 0.89 LMNA (0.41) SMN1; SMN2ALDH1A1KDM4ELMNAPOLB
SCHEMBL8089467 0.81 MAPT (0.41) SMN1; SMN2ALDH1A1KDM4ELMNATSHR
SCHEMBL8081430 0.77 PTK2 (0.41) SMN1; SMN2ALDH1A1KDM4ETSHRALOX15
SCHEMBL1004434 0.68 TSHR (0.40) SMN1; SMN2ALDH1A1KDM4ETSHRMEN1
SCHEMBL1006811 0.64 KDM4A (0.37) ESR1
SCHEMBL29953023 0.62 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1LMNAPOLBTSHR
SCHEMBL8088618 0.61 MEN1 (0.45) SMN1; SMN2ALDH1A1KDM4ELMNAPOLB
SCHEMBL7052350 0.61 TSHR (0.74) SMN1; SMN2ALDH1A1LMNAPOLBTSHR
SCHEMBL13844718 0.60 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1KDM4ELMNATSHR
SCHEMBL3999663 0.60 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1KDM4ETSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054667-A1 BICYCLIC PYRROLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIINFLAMMATORY AND IMMUNOMODULATING AGENTS AstraZeneca UK Limited (GB) 2000-11-29 EP disclosed
WO-1999040913-A1 CHEMICAL COMPOUNDS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO disclosed