SCHEMBL8750441

SCHEMBL8750441

CCCc1ccc(COCc2ccc(CCC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.48
LIPG Q9Y5X9 2/20 0.48
TSHR P16473 1/20 0.48
CA2 P00918 1/20 0.45
GPR84 Q9NQS5 1/20 0.43
THRB P10828 2/20 0.42
MGLL Q99685 1/20 0.42
PLK1 P53350 1/20 0.42
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 1/20 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
SCHEMBL8750358 0.90 LPL (0.45) LPLLIPGTSHRCA2GPR84
SCHEMBL19000436 0.86 LPL (0.47) LPLLIPGCA2GPR84THRB
SCHEMBL8897670 0.85 ALDH1A1 (0.54) LPLLIPGTSHRCA2THRB
SCHEMBL27430936 0.84 MCL1 (0.41) LPLLIPGTSHRCA2GPR84
SCHEMBL9598141 0.83 ALDH1A1 (0.63) LPLLIPGCA2THRBMGLL
SCHEMBL142480 0.83 LPL (0.62) LPLLIPGCA2THRBMGLL
SCHEMBL26189797 0.83 TAAR1 (0.43) LPLLIPGCA2GPR84ADRA2A
SCHEMBL14232112 0.82 LPL (0.46) LPLLIPGCA2GPR84THRB
SCHEMBL10463150 0.81 ALDH1A1 (0.67) LPLLIPGTSHRMGLLESR1
SCHEMBL8750600 0.81 ALDH1A1 (0.67) LPLLIPGTSHRMGLLESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111527158-B Ink composition for organic light emitting device 株式会社LG化学 2022-05-31 CN claimed
CN-111527158-A Ink composition for organic light emitting device 株式会社LG化学 2020-08-11 CN claimed
EP-0523697-B1 Color-developing compositions and their use MITSUI TOATSU CHEMICALS (JP) 1997-04-02 EP disclosed
EP-0268878-B1 Salicylic acid copolymers and their metal salts, production process thereof, color-developing agents comprising metal salts of the copolymers and color-developing sheets employing the agents MITSUI TOATSU CHEMICALS (JP) 1996-01-31 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
US-5023366-A Reacted with a benzyl halide, alcohol or ether; for pressure sensitive elements MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1991-06-11 US disclosed
US-4913837-A Heterocyclic compounds MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-04-03 US disclosed
EP-0268878-A2 Salicylic acid copolymers and their metal salts, production process thereof, color-developing agents comprising metal salts of the copolymers and color-developing sheets employing the agents MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-06-01 EP disclosed