SCHEMBL5025933

SCHEMBL5025933

C=CCC(c1cc(C(C)(C)C)cc(C(C)(C)C)c1O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 4/20 0.58
CYP3A4 P08684 3/20 0.58
CYP2C9 P11712 3/20 0.58
TSHR P16473 3/20 0.58
CYP1A2 P05177 2/20 0.58
HSP90AA1 P07900 1/20 0.37
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
NR5A2 O00482 1/20 0.36
NR5A1 Q13285 1/20 0.36
ALOX5 P09917 1/20 0.35
PTGS2 P35354 1/20 0.35
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
POLB P06746 1/20 0.35
TYR P14679 1/20 0.35
GLRA3 O75311 1/20 0.35
GLRB P48167 1/20 0.35
MAPK1 P28482 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34

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
SCHEMBL11134140 0.89 CYP2C19 (0.73) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
SCHEMBL11134146 0.85 CYP3A4 (0.56) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
SCHEMBL5032132 0.84 ALDH1A1 (0.52) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
SCHEMBL8851966 0.82 CYP2C19 (0.67) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
Acrylic Acid SCHEMBL9576773 0.80 CYP2C9 (0.54) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
SCHEMBL2164224 0.80 CYP2C19 (0.79) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
Acrylic Acid SCHEMBL8878215 0.79 CYP3A4 (0.49) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
Acrylic Acid SCHEMBL9820576 0.79 CYP3A4 (0.49) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
SCHEMBL6397556 0.78 CYP2C19 (0.61) CYP2C19CYP3A4CYP2C9TSHRCYP1A2
SCHEMBL4594355 0.78 CYP2C19 (0.66) CYP2C19CYP3A4CYP2C9TSHRCYP1A2

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
US-7267914-B2 Electrophotographic photoconductor, process cartridge, image forming apparatus and image forming method RICOH COMPANY, LTD. (JP) 2007-09-11 US claimed
US-7348115-B2 Electrophotographic photoconductor, process cartridge, image forming apparatus and image forming method RICOH COMPANY, LTD. (JP) 2008-03-25 US disclosed
US-7267914-B2 Electrophotographic photoconductor, process cartridge, image forming apparatus and image forming method RICOH COMPANY, LTD. (JP) 2007-09-11 US disclosed
US-20050170271-A1 Electrophotographic photoconductor, process cartridge, image forming apparatus and image forming method YAMANAMI HIROFUMI (JP) 2005-08-04 US disclosed
US-20030232265-A1 Electrophotographic photoconductor, process cartridge, image forming apparatus and image forming method RICOH COMPANY, LTD. (JP) 2003-12-18 US disclosed
EP-1324139-A2 Electrophotographic photoconductor, process cartridge, image forming apparatus and image forming method Ricoh Company, Ltd. (JP) 2003-07-02 EP disclosed
US-5670284-A HAVING CHARGE GENERATING LAYER COMPRISING POLYALKYLENE GLYCOL AND/OR ESTER OR ETHER THEREOF AND/OR CROWN ETHER, CHARGE TRANSPORT LAYER COMPRISING ANTIOXIDANT RICOH COMPANY, LTD. (JP) 1997-09-23 US disclosed