SCHEMBL8944054

SCHEMBL8944054

Cc1ccc(Nc2cccc(OCc3ccc(COc4cccc(Nc5ccc(C)cc5)c4Nc4ccc(C)cc4)cc3)c2Nc2ccc(C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44
MAPT P10636 4/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SGMS2 Q8NHU3 1/20 0.42
APP P05067 1/20 0.42
MAOB P27338 3/20 0.42
MAOA P21397 1/20 0.42
GAA P10253 1/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41

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
SCHEMBL8943788 0.92 SGMS2 (0.41) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL8943773 0.86 MAPT (0.45) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL8943973 0.86 ALDH1A1 (0.49) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL8944280 0.85 MAPT (0.44) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL8944343 0.85 ALDH1A1 (0.46) HTR1AMAPTTDP1MAPK1ALDH1A1
SCHEMBL8943993 0.79 ALDH1A1 (0.51) MAPTTDP1L3MBTL1MAPK1ALDH1A1
SCHEMBL8943593 0.78 ALDH1A1 (0.47) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL8943655 0.77 MAPT (0.45) MAPTTDP1L3MBTL1MAPK1ALDH1A1
SCHEMBL8944045 0.76 CTSV (0.43) MAPTL3MBTL1ALDH1A1LMNACYP1A2
SCHEMBL8944203 0.76 GAA (0.44) MAPTTDP1ALDH1A1LMNAGAA

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-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed