SCHEMBL17263289

SCHEMBL17263289

Cc1ccc(-c2ncc(C)nc2C)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.46
HSP90AB1 P08238 4/20 0.37
LMNA P02545 2/20 0.36
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 6/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
TP53 P04637 2/20 0.35
GAA P10253 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HPGD P15428 2/20 0.35
CYP17A1 P05093 1/20 0.35
PDE10A Q9Y233 1/20 0.34
CCR1 P32246 1/20 0.34
CCR5 P51681 1/20 0.34
CCR8 P51685 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL20171948 0.86 HSP90AB1 (0.37) JAK3HSP90AB1LMNARAB9ANPC1
SCHEMBL11438697 0.83 DRD1 (0.39) HSP90AB1RAB9ANPC1MEN1KMT2A
SCHEMBL17263290 0.79 JAK3 (0.48) JAK3LMNARAB9ANPC1MEN1
SCHEMBL17263288 0.77 JAK3 (0.45) JAK3NPC1MEN1KMT2AMAPT
SCHEMBL18356854 0.77 CNR2 (0.44) HSP90AB1LMNARAB9ANPC1MEN1
SCHEMBL17263278 0.76 HSP90AB1 (0.39) HSP90AB1LMNARAB9ANPC1MEN1
SCHEMBL15256080 0.73 NPC1 (0.40) LMNARAB9ANPC1MEN1KMT2A
SCHEMBL4754291 0.72 JAK3 (0.44) JAK3LMNAMAPTNPSR1ALOX15
SCHEMBL26155339 0.72 CYP1A2 (0.45) HSP90AB1LMNARAB9ANPC1MEN1
SCHEMBL22686569 0.71 MAPT (0.41) HSP90AB1LMNARAB9ANPC1MEN1

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-9187689-B2 Organometallic complex and light-emitting element, light-emitting device, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-11-17 US disclosed