SCHEMBL8750378

SCHEMBL8750378

CCCC(OC(CCC)C(C)c1ccccc1)C(C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.41
MME P08473 2/20 0.40
TAAR1 Q96RJ0 3/20 0.38
LMNA P02545 2/20 0.38
RIPK1 Q13546 1/20 0.37
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM1 P11229 1/20 0.36
SMPD1 P17405 1/20 0.36
DRD1 P21728 1/20 0.36
TBXA2R P21731 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36
CASR P41180 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL31412792 0.85 ALDH1A1 (0.42) MMEOPRM1KCNH2SMN1; SMN2POLB
SCHEMBL8750464 0.83 LMNA (0.45) AOC3MMETAAR1LMNARIPK1
SCHEMBL8750508 0.82 CA12 (0.38) LMNASLC6A2SLC6A4SLC6A3SMN1; SMN2
SCHEMBL8750475 0.78 HKDC1 (0.44) AOC3TAAR1LMNACHRM2ADORA3
SCHEMBL29054023 0.77 MME (0.46) AOC3MMETAAR1LMNARIPK1
SCHEMBL2464535 0.75 TAAR1 (0.47) AOC3MMETAAR1LMNARIPK1
SCHEMBL19810862 0.74 LMNA (0.39) AOC3LMNARIPK1CHRM1SLC6A2
SCHEMBL13849318 0.73 AOC3 (0.50) AOC3MMELMNARIPK1CHRM2
SCHEMBL20738581 0.73 AOC3 (0.50) AOC3MMELMNARIPK1CHRM2
SCHEMBL14402548 0.73 AOC3 (0.50) AOC3MMELMNARIPK1CHRM2

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