SCHEMBL25547357

SCHEMBL25547357

N#Cc1ccc(-c2ccc(N(c3ccc(CSc4ccccc4N)cc3)c3ccc(-c4ccc(C#N)cc4)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
MAOB P27338 5/20 0.46
MAOA P21397 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
CTSB P07858 1/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
IDO1 P14902 2/20 0.39
CYP2A6 P11509 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 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
SCHEMBL16242598 0.74 POLB (0.87) POLBRAB9AMAPTSMN1; SMN2SLC6A2
SCHEMBL25543620 0.73 TSHR (0.52) MAOBMAOAL3MBTL1MAPTTSHR
SCHEMBL10029850 0.73 TSHR (0.52) MAOBMAOAL3MBTL1MAPTTSHR
SCHEMBL10029827 0.73 TSHR (0.52) MAOBMAOAL3MBTL1MAPTTSHR
SCHEMBL15807463 0.73 TSHR (0.52) MAOBMAOAL3MBTL1MAPTTSHR
SCHEMBL16484549 0.73 TSHR (0.52) MAOBMAOAL3MBTL1MAPTTSHR
SCHEMBL16484551 0.73 TSHR (0.52) MAOBMAOAL3MBTL1MAPTTSHR
SCHEMBL15807473 0.73 TSHR (0.52) MAOBMAOAL3MBTL1MAPTTSHR
SCHEMBL25544242 0.73 TSHR (0.52) MAOBMAOAL3MBTL1MAPTTSHR
SCHEMBL5866083 0.73 MAOB (0.61) POLBMAOBMAOAL3MBTL1CTSB

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-4183784-A1 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME Lapto Co., Ltd. (KR) 2023-05-24 EP disclosed