SCHEMBL8469823

SCHEMBL8469823

CCCCCCCCOc1ccc(-c2ccc(C(=O)OC(=O)OC(C)CCCCCC)cc2-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 4/20 0.48
RARB P10826 4/20 0.47
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 1/20 0.44
PLA2G4B P0C869 3/20 0.44
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
PPARG P37231 2/20 0.41
PPARA Q07869 1/20 0.41
PLA2G4A P47712 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
SCHEMBL7857245 1.00 PTPN11 (0.48) PTPN11RARBTP53TSHRALDH1A1
SCHEMBL8610992 1.00 PTPN11 (0.48) PTPN11RARBTP53TSHRALDH1A1
SCHEMBL10581613 0.88 PTPN11 (0.52) PTPN11RARBTP53TSHRALDH1A1
SCHEMBL9850409 0.88 RARB (0.48) RARBALDH1A1THRATHRB
SCHEMBL9350092 0.88 ALDH1A1 (0.45) ALDH1A1THRATHRB
SCHEMBL9056810 0.87 PTPN11 (0.46) PTPN11RARBTP53TSHRPLA2G4B
SCHEMBL9057375 0.87 PTPN11 (0.46) PTPN11RARBTP53TSHRPLA2G4B
SCHEMBL9058016 0.87 PTPN11 (0.46) PTPN11RARBTP53TSHRPLA2G4B
SCHEMBL9057349 0.87 PTPN11 (0.46) PTPN11RARBTP53TSHRPLA2G4B
SCHEMBL10594661 0.87 PTPN11 (0.46) PTPN11RARBTP53TSHRPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5908723-A Recording sheets XEROX CORPORATION (US) 1999-06-01 US claimed
US-5876492-A Ink compositions containing esters XEROX CORPORATION (US) 1999-03-02 US claimed
US-5876492-A Ink compositions containing esters XEROX CORPORATION (US) 1999-03-02 US disclosed
US-5846637-A Coated xerographic photographic paper XEROX CORPORATION (US) 1998-12-08 US disclosed
US-5763128-A Simulated photographic-quality images on a substrate without curl XEROX CORPORATION (US) 1998-06-09 US disclosed
EP-0418604-B1 Liquid crystal compound SHOWA SHELL SEKIYU (JP) 1994-08-03 EP disclosed
US-5116531-A LIQUID CRYSTAL COMPOUND SHOWA SHELL SEKIYU K.K. (JP) 1992-05-26 US disclosed
EP-0418604-A1 Liquid crystal compound Showa Shell Sekiyu Kabushiki Kaisha (JP) 1991-03-27 EP disclosed