SCHEMBL8748176

SCHEMBL8748176

CC(C)(c1cc[c]cc1)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
CYP2C19 P33261 1/20 0.50
PTGS2 P35354 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HIF1A Q16665 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
MAOA P21397 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
APP P05067 1/20 0.46
BCHE P06276 1/20 0.46
NR4A2 P43354 2/20 0.46

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
SCHEMBL10013799 0.90 LMNA (0.60) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL1681364 0.89 SMN1; SMN2 (0.60) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL6059276 0.85 LMNA (0.55) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL16016724 0.85 LMNA (0.55) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL20171740 0.85 LMNA (0.55) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL6059951 0.84 SLC6A2 (0.73) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL1282632 0.81 LMNA (0.62) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL76993 0.81 LMNA (0.61) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL419050 0.80 APP (0.69) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL16016779 0.80 LMNA (0.60) MAOBLMNACYP1A2PTGS1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0534257-B1 Salicylic acid derivatives, the process for preparing the same and the heat-sensitive recording materials comprising thereof MITSUI TOATSU CHEMICALS (JP) 1997-03-12 EP disclosed
EP-0524419-B1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS (JP) 1995-09-06 EP disclosed
US-5391806-A A storage stable chromogens as color-developing agent or stabilizers MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-02-21 US disclosed
US-5306688-A Color-forming, electron donating compound and electron accepting compound; storage stability of uncolored portion MITSUI TOATSU CHEMICALS, INC. (JP) 1994-04-26 US disclosed
US-5270281-A Chromogenic compound MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-12-14 US disclosed
EP-0534257-A1 Salicylic acid derivatives, the process for preparing the same and the heat-sensitive recording materials comprising thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-03-31 EP disclosed
EP-0524419-A1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-27 EP disclosed