SCHEMBL6197350

SCHEMBL6197350

Cc1cccc(-c2ccc(C(=O)O)c(=O)[nH]2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.69
GAA P10253 2/20 0.55
ALDH1A1 P00352 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
AKR1C2 P52895 1/20 0.47
AKR1C1 Q04828 1/20 0.47
PIN1 Q13526 1/20 0.47
DHODH Q02127 2/20 0.46
POLB P06746 1/20 0.45
MCL1 Q07820 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KMO O15229 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CDC7 O00311 1/20 0.41

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
SCHEMBL25149490 0.86 KDM4E (0.65) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL4074628 0.82 KDM4E (1.00) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL11116264 0.82 KDM4E (0.69) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL11738892 0.81 KDM4E (0.63) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL11733491 0.81 KDM4E (0.63) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL25149281 0.81 KDM4E (0.72) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL11255696 0.80 KDM4E (0.61) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL25148578 0.80 KDM4E (0.61) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL31547667 0.80 KDM4E (0.61) KDM4EGAAALDH1A1SMN1; SMN2RXFP1
SCHEMBL21686405 0.80 KDM4E (0.65) KDM4EAKR1C2AKR1C1PIN1DHODH

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-1562902-A1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE AstraZeneca AB (SE) 2005-08-17 EP disclosed
WO-2004043924-A1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2004-05-27 WO disclosed