SCHEMBL6556005

SCHEMBL6556005

CCOC(=O)C(Cc1ccc(OCc2nc3ccccc3c(=O)n2C)cc1)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
KDM4E B2RXH2 1/20 0.57
ALOX15 P16050 1/20 0.57
TSHR P16473 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
PPARG P37231 5/20 0.53
PPARA Q07869 5/20 0.49
PPARD Q03181 2/20 0.49
ACKR3 P25106 5/20 0.46
PDE10A Q9Y233 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
LMNA P02545 1/20 0.45
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL6555798 0.94 KDM4E (0.59) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6557264 0.92 KDM4E (0.56) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6557314 0.91 L3MBTL1 (0.55) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6555895 0.91 KDM4E (0.59) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6555903 0.91 KDM4E (0.61) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6555771 0.90 KDM4E (0.54) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6557982 0.90 L3MBTL1 (0.58) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6556030 0.89 L3MBTL1 (0.52) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6555825 0.87 PPARA (0.61) L3MBTL1KDM4EALOX15TSHRTDP1
SCHEMBL6556037 0.85 PPARA (0.51) L3MBTL1KDM4EALOX15TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1073643-B1 NEW HETEROCYCLIC COMPOUNDS AND THEIR USE IN MEDICINE, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM REDDYS LAB LTD DR (IN) 2004-12-29 EP claimed