SCHEMBL7055136

SCHEMBL7055136

CCCc1ccc2nc(O)c(CC(=O)OCC)c(O)c2c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.38
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
AHR P35869 1/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
HPGD P15428 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
RAB9A P51151 1/20 0.37
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
GLA P06280 1/20 0.35

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
SCHEMBL7061260 0.92 KDM4E (0.40) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7055635 0.88 KDM4E (0.39) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7057147 0.86 KDM4E (0.39) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7059144 0.84 ELANE (0.44) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7056212 0.82 KDM4E (0.41) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7061675 0.82 KDM4E (0.37) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7057726 0.79 MAPK1 (0.36) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL6492344 0.79 HSD17B10 (0.42) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL7059106 0.76 MAPK1 (0.34) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL6499160 0.76 HSD17B10 (0.44) KDM4EMAPTALDH1A1MEN1KMT2A

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
WO-2003035618-A2 MODULATORS OF PHOSPHOINOSITIDE 3-KINASE ICONIX PHARMACEUTICALS, INC. (US) 2003-05-01 WO disclosed