SCHEMBL6207810

SCHEMBL6207810

COc1cc2cc(C(=O)N3CC(CCl)c4c3cc(N)c3[nH]c(C(=O)O)cc43)[nH]c2c(OC)c1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
HPGD P15428 2/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
P4HB P07237 1/20 0.49
HSP90AA1 P07900 1/20 0.49
KMT2A Q03164 3/20 0.35
POLB P06746 2/20 0.35
MEN1 O00255 2/20 0.35
RAB9A P51151 1/20 0.35
CFD P00746 7/20 0.34
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
ADH1A P07327 1/20 0.33
KIT P10721 1/20 0.33
FLT1 P17948 1/20 0.33
FLT4 P35916 1/20 0.33
KDR P35968 1/20 0.33
ABL2 P42684 1/20 0.33
HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL5623612 0.93 P4HB (0.49) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL6203889 0.89 KDM4E (0.50) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL6207842 0.89 KDM4E (0.49) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL6207805 0.88 KDM4E (0.48) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL6207800 0.88 KDM4E (0.48) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL31294373 0.88 P4HB (0.54) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL5623207 0.88 P4HB (0.54) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL5622947 0.88 P4HB (0.54) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL5624264 0.88 P4HB (0.54) KDM4EHPGDALDH1A1LMNAP4HB
SCHEMBL30852740 0.87 P4HB (0.51) KDM4EHPGDALDH1A1LMNAP4HB

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-0938474-B1 CYCLOPROPYLINDOLE COMPOUNDS AND THEIR USE AS PRODRUGS AUCKLAND UNISERVICES LTD (NZ) 2005-11-23 EP claimed