SCHEMBL8750433

SCHEMBL8750433

CCc1ccc(CCCCCOCCCCCc2ccc(CC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
CYP3A4 P08684 2/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
MAPK1 P28482 1/20 0.47
CASP1 P29466 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SLCO1B3 Q9NPD5 1/20 0.47
SLCO1B1 Q9Y6L6 1/20 0.47
TAAR1 Q96RJ0 1/20 0.46
ESR1 P03372 2/20 0.45
ADRA2A P08913 2/20 0.45
ADORA3 P0DMS8 2/20 0.45
TACR2 P21452 2/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A4 P31645 2/20 0.45

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
SCHEMBL18531554 0.98 ALDH1A1 (0.50) TDP1L3MBTL1ALDH1A1LMNACYP3A4
SCHEMBL21175586 0.98 TAAR1 (0.48) TDP1L3MBTL1ALDH1A1LMNACYP3A4
SCHEMBL18857053 0.90 ALDH1A1 (0.47) TDP1L3MBTL1ALDH1A1LMNACYP3A4
SCHEMBL9357895 0.87 ALDH1A1 (0.61) ALDH1A1LMNACYP3A4MEN1USP2
SCHEMBL10571221 0.86 TAAR1 (0.59) ALDH1A1LMNACYP3A4TAAR1ESR1
SCHEMBL21175577 0.84 ALDH1A1 (0.53) TDP1L3MBTL1ALDH1A1LMNACYP3A4
SCHEMBL10575050 0.83 TAAR1 (0.62) ALDH1A1LMNACYP3A4TAAR1ESR1
SCHEMBL9574215 0.83 KCNH2 (0.43) TDP1L3MBTL1ALDH1A1LMNACYP3A4
SCHEMBL9574312 0.83 KCNH2 (0.43) TDP1L3MBTL1ALDH1A1LMNACYP3A4
SCHEMBL8750399 0.83 KCNH2 (0.53) TDP1L3MBTL1ALDH1A1LMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0523697-B1 Color-developing compositions and their use MITSUI TOATSU CHEMICALS (JP) 1997-04-02 EP disclosed
US-5447901-A Color-developing sheet: base material coated with composition of /a/ multivalent metal-modified salicylic acid resin formed from salicylic acid, a benzyl compound and optional styrene and /b/ analogous resin free of salicylic acid MITSUI TOATSU CHEMICAL, INC. (JP) 1995-09-05 US disclosed
US-5376615-A Pressure sensitive elements containing a salicylic acid resin and a phenolic resin MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1994-12-27 US disclosed
EP-0523697-A1 Color-developing compositions and their use MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-20 EP disclosed