SCHEMBL10109604

SCHEMBL10109604

Cc1ccc(N(c2ccc(-c3cccc(C4CCCCC4)c3)cc2)C2CCC(C)CC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.35
SLC5A2 P31639 1/20 0.34
HTR2C P28335 2/20 0.33
CTSS P25774 2/20 0.33
CTSK P43235 2/20 0.33
NMT1 P30419 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CASP3 P42574 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
XBP1 P17861 1/20 0.31

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
SCHEMBL10109594 0.80 MEN1 (0.37) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL10109582 0.79 SIGMAR1 (0.38) HTR2CNPC1RAB9ALMNAMAPT
SCHEMBL13968327 0.76 TSHR (0.39) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL10109623 0.74 KCNH2 (0.37)
SCHEMBL10109405 0.74 ESR2 (0.44) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL23587787 0.74 KMO (0.46) KMOCTSSCTSKHDAC4HDAC2
SCHEMBL8377504 0.72 KDM4E (0.45) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL778007 0.71 KMO (0.56) KMOCTSSCTSKHDAC4HDAC2
SCHEMBL516360 0.71 MEN1 (0.49) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL12311577 0.69 ADORA1 (0.52) KMOCTSSCTSKMEN1KMT2A

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-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed