SCHEMBL6249254

SCHEMBL6249254

Cc1cccc(N(c2ccc(C3(c4ccc(N(c5cccc(C)c5)c5cccc(C)c5)cc4)CCC(C)CC3)cc2)c2cccc(C)c2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA1 P02708 1/20 0.33
CHRNG P07510 1/20 0.33
CHRNB1 P11230 1/20 0.33
CHRNB2 P17787 1/20 0.33
SLC6A2 P23975 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
SLC6A3 Q01959 1/20 0.33
CHRND Q07001 1/20 0.33
HTR2C P28335 4/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
NSD2 O96028 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32

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
SCHEMBL77382 0.85 ALDH1A1 (0.38) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL13030464 0.84 ESR1 (0.41) MEN1NPC1NSD2CASP3RAB9A
SCHEMBL14186193 0.82 ICMT (0.34) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL10086974 0.81 ESR1 (0.40) ACHE
SCHEMBL29396784 0.81 ESR1 (0.40) ACHE
SCHEMBL13030462 0.81 ESR1 (0.40) ICMTACHE
SCHEMBL13030465 0.81 ESR1 (0.40) ACHE
SCHEMBL8766953 0.78 CCR2 (0.42) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL4602820 0.78 OPRM1 (0.34) MEN1KMT2A
SCHEMBL13030475 0.78 ESR1 (0.40) ACHE

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
WO-2005057678-A1 ORGANIC ELECTROLUMINESCENT DEVICES WITH ADDITIVE EASTMAN KODAK COMPANY (US) 2005-06-23 WO disclosed