SCHEMBL8094936

SCHEMBL8094936

CCCCCCCCOc1cccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(C)cc3)n2)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.41
PTPN11 Q06124 3/20 0.40
PDE5A O76074 2/20 0.39
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
MEN1 O00255 1/20 0.39
NR1I2 O75469 1/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADRA2A P08913 1/20 0.39
MAPT P10636 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CNR1 P21554 5/20 0.38

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
SCHEMBL6054722 0.90 PTPN11 (0.46) MCHR1PTPN11PDE5APDE4APDE4B
SCHEMBL7249597 0.90 MCHR1 (0.49) MCHR1PTPN11PDE5APDE4APDE4B
SCHEMBL7607965 0.88 PLA2G4B (0.36) MCHR1PTPN11LMNAMAPTKMT2A
SCHEMBL1424639 0.86 MCHR1 (0.40) MCHR1PTPN11PDE5APDE4APDE4B
SCHEMBL5602712 0.86 MCHR1 (0.40) MCHR1PTPN11PDE5APDE4APDE4B
SCHEMBL31258167 0.86 MCHR1 (0.40) MCHR1PTPN11PDE5APDE4APDE4B
SCHEMBL4791409 0.86 MCHR1 (0.40) MCHR1PTPN11PDE5APDE4APDE4B
SCHEMBL16781412 0.85 GRM2 (0.41) PTPN11
SCHEMBL8848507 0.78 LTB4R (0.45) MEN1MAPTKMT2ACNR1CNR2
SCHEMBL14085534 0.77 MAPT (0.45) MEN1LMNAMAPTKMT2ADHPS

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6087062-A COINITIATOR INCLUDING ELECTRON ACCEPTOR COMPOUND; EFFICIENCY, PHOTOSENSITIVITY CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-07-11 US disclosed
EP-0548015-A1 Tetramethylpiperidine compounds for use as stabilisers for organic materials CIBA-GEIGY AG (CH) 1993-06-23 EP disclosed