SCHEMBL8435813

SCHEMBL8435813

COc1ccc(C(OC(c2ccc(Cl)cc2)c2ccc(OC)c(C)c2)c2ccc(Cl)cc2)cc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
IDO1 P14902 4/20 0.39
TDO2 P48775 4/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
HDAC8 Q9BY41 1/20 0.36
TSHR P16473 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
SCN4A P35499 1/20 0.36
CYP3A4 P08684 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GRIN2D O15399 4/20 0.34
GRIN3B O60391 4/20 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
SCHEMBL8439068 0.81 IDO1 (0.40) MAPTIDO1TDO2SLC6A4SLC6A3
SCHEMBL91412 0.76 TSHR (0.50) SLC6A2SLC6A4SLC6A3TSHRHTR2A
SCHEMBL4668171 0.75 IDO1 (0.61) IDO1TDO2SLC6A3TSHR
SCHEMBL31135381 0.74 SLC6A2 (0.44) MAPTSLC6A2SLC6A4SLC6A3CYP3A4
SCHEMBL8440000 0.74 HPGD (0.50) IDO1TDO2TSHRCYP1A2CYP2C19
SCHEMBL9771532 0.74 IDO1 (0.50) IDO1TDO2SLC6A3TSHRPOLB
SCHEMBL1021723 0.74 TSHR (0.49) SLC6A2SLC6A4SLC6A3TSHRHTR2A
SCHEMBL8435809 0.73 TSHR (0.41) MAPTIDO1TDO2TSHRCYP1A2
SCHEMBL14499410 0.73 CYP3A4 (0.50) MAPTTSHRCYP3A4CYP1A2CYP2C19
SCHEMBL9771607 0.72 IDO1 (0.53) MAPTIDO1TDO2SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0963858-A2 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1999-12-15 EP disclosed
EP-0844099-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1998-05-27 EP disclosed
US-5661101-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1997-08-26 US disclosed