SCHEMBL16366502

SCHEMBL16366502

Cc1ccc(Nc2ccc3c(c2)C(C)(C)c2cc(-c4ccc(-c5ccccc5)cc4)ccc2-3)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
PDK2 Q15119 5/20 0.45
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
APP P05067 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
GBA1 P04062 1/20 0.40
PGR P06401 1/20 0.39
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37

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
SCHEMBL14174163 0.97 HPGD (0.51) HPGDPDK2LMNATP53POLB
SCHEMBL16366599 0.94 PDK2 (0.46) HPGDPDK2LMNAMAPTAPP
SCHEMBL9916964 0.94 PDK2 (0.46) HPGDPDK2LMNAMAPTAPP
SCHEMBL16366511 0.94 PDK2 (0.46) HPGDPDK2LMNAMAPTAPP
SCHEMBL15713473 0.94 PDK2 (0.46) HPGDPDK2LMNAMAPTAPP
SCHEMBL16366512 0.93 PDK2 (0.48) HPGDPDK2LMNAMAPTAPP
SCHEMBL9916951 0.93 PDK2 (0.48) HPGDPDK2LMNAMAPTAPP
SCHEMBL9916948 0.93 PDK2 (0.43) PDK2LMNAMAPTAPPNPSR1
SCHEMBL13486731 0.91 PDK2 (0.48) HPGDPDK2LMNATP53POLB
SCHEMBL15030815 0.91 PDK2 (0.48) HPGDPDK2LMNAMAPTAPP

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-2816025-A1 AROMATIC AMINE DERIVATIVE, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd (JP) 2014-12-24 EP disclosed