SCHEMBL4797393

SCHEMBL4797393

CCCCCC1CCC(CCC2CCC(c3ccccc3CCC)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
GAA P10253 3/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MAPK1 P28482 2/20 0.38
CYP1A2 P05177 2/20 0.38
NPC1 O15118 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYSLTR2 Q9NS75 2/20 0.37
CYSLTR1 Q9Y271 2/20 0.37
BCHE P06276 2/20 0.36
OPRL1 P41146 3/20 0.35
HRH3 Q9Y5N1 1/20 0.35
LIPG Q9Y5X9 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
SCHEMBL4797383 1.00 MAPT (0.38) MAPTGAAMEN1KMT2AMAPK1
SCHEMBL27960976 0.88 CYP1A2 (0.41) MAPTGAAMEN1KMT2AMAPK1
SCHEMBL11474957 0.88 CYP2C9 (0.41) MAPTMEN1KMT2AMAPK1CYP2C9
SCHEMBL11034104 0.84 CYSLTR2 (0.36) MAPTGAAMEN1KMT2AMAPK1
SCHEMBL8416013 0.81 BCHE (0.44) MAPTGAAMEN1KMT2AMAPK1
SCHEMBL20888558 0.81 MAPT (0.38) MAPTGAAMEN1KMT2AMAPK1
SCHEMBL9766625 0.81 GAA (0.37) MAPTGAAMEN1KMT2AMAPK1
SCHEMBL11071980 0.79 SLC6A4 (0.37) MEN1KMT2ACYSLTR2CYSLTR1DRD2
SCHEMBL11071982 0.79 SLC6A4 (0.37) MEN1KMT2ACYSLTR2CYSLTR1DRD2
SCHEMBL5676928 0.79 OPRL1 (0.41) MAPTGAAMEN1KMT2AMAPK1

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-7445818-B2 Matrix liquid crystal display MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-11-04 US disclosed
US-20070275182-A1 Matrix liquid crystal display WEBER GEORG 2007-11-29 US disclosed