SCHEMBL14264124

SCHEMBL14264124

COc1ccc(-c2cc(-c3ccccc3)c3cc(C(=O)c4ccc5nc(-c6ccc(C)cc6)cc(-c6ccccc6)c5c4)ccc3n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.62
AURKB Q96GD4 1/20 0.62
ACACA Q13085 1/20 0.62
MAPT P10636 8/20 0.58
TP53 P04637 2/20 0.58
DHODH Q02127 1/20 0.53
PLA2G2A P14555 2/20 0.52
ACP1 P24666 1/20 0.52
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
HSD17B10 Q99714 1/20 0.51
MEN1 O00255 1/20 0.51
RECQL P46063 1/20 0.51
KMT2A Q03164 1/20 0.51
HPGD P15428 2/20 0.49
HSP90AA1 P07900 1/20 0.49

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
SCHEMBL14264128 0.89 AURKA (0.62) AURKAAURKBACACAMAPTTP53
SCHEMBL14264119 0.87 ACACA (0.72) AURKAAURKBACACAMAPTTP53
SCHEMBL14264126 0.86 ACACA (0.71) AURKAAURKBACACAMAPTTP53
SCHEMBL27986490 0.85 ACACA (0.74) AURKAAURKBACACAMAPTTP53
SCHEMBL21799200 0.85 ACACA (0.74) AURKAAURKBACACAMAPTTP53
SCHEMBL14264120 0.84 ACACA (0.69) AURKAAURKBACACAMAPTTP53
SCHEMBL14264122 0.82 AURKA (0.62) AURKAAURKBACACAMAPTTP53
SCHEMBL14264121 0.81 AURKA (0.65) AURKAAURKBACACAMAPTTP53
SCHEMBL14264127 0.81 AURKA (0.63) AURKAAURKBACACAMAPTTP53
SCHEMBL14264118 0.81 AURKA (0.63) AURKAAURKBACACAMAPTTP53

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
US-20080070086-A1 Phase-Separated Polymer Electrolyte Membrane, Electrode - Phase-Separated Polymer Electrolyte Membrane Joint Using Same, Method for Manufacture Thereof, and Fuel Cell Using Same HITACHI CHEMICAL COMPANY, LTD. (JP) 2008-03-20 US disclosed
US-20080070086-A1 Phase-Separated Polymer Electrolyte Membrane, Electrode - Phase-Separated Polymer Electrolyte Membrane Joint Using Same, Method for Manufacture Thereof, and Fuel Cell Using Same HITACHI CHEMICAL COMPANY, LTD. (JP) 2008-03-20 US disclosed