SCHEMBL8024297

SCHEMBL8024297

CCc1cc(C)nc2c(O)cccc12.CCc1cc(C)nc2c(O)cccc12.[Al].[Al]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
KMT2A Q03164 2/20 0.46
PARP1 P09874 2/20 0.46
CYP1A2 P05177 2/20 0.46
MEN1 O00255 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
METAP2 P50579 1/20 0.46
CCR6 P51684 1/20 0.44
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
OPRK1 P41145 1/20 0.41
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
BRD4 O60885 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL8072010 1.00 KDM4E (0.46) KDM4EKMT2APARP1CYP1A2MEN1
SCHEMBL30587191 0.98 KDM4E (0.47) KDM4EKMT2APARP1CYP1A2MEN1
SCHEMBL2877622 0.98 KDM4E (0.47) KDM4EKMT2APARP1CYP1A2MEN1
SCHEMBL27527696 0.97 KDM4E (0.46) KDM4EKMT2APARP1CYP1A2MEN1
SCHEMBL6640320 0.87 KMT2A (0.57) KDM4EKMT2APARP1CYP1A2MEN1
SCHEMBL11545600 0.81 TP53 (0.51) KDM4EKMT2APARP1MEN1LMNA
SCHEMBL6639396 0.81 KDM4E (0.52) KDM4EKMT2APARP1CYP1A2MEN1
SCHEMBL29966202 0.80 KDM4E (0.61) KDM4EKMT2APARP1CYP1A2MEN1
SCHEMBL11640173 0.79 KDM4E (0.65) KDM4EKMT2APARP1MEN1LMNA
SCHEMBL11570729 0.79 NR4A2 (0.61) KDM4EPARP1MAPTTDP1NR4A2

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
US-6091078-A Organic EL display device having separating groove structures between adjacent elements TDK CORPORATION (JP) 2000-07-18 US disclosed