SCHEMBL9788485

SCHEMBL9788485

COc1cc(O)c(CC=C(C)C)cc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.52
CYP3A4 P08684 3/20 0.51
HTT P42858 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
HPGD P15428 1/20 0.51
CYP2C19 P33261 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
PTGS2 P35354 3/20 0.49
PTGS1 P23219 2/20 0.49
SMPD1 P17405 1/20 0.48
ALOX5 P09917 3/20 0.48
PTGES O14684 1/20 0.48
NFKB1 P19838 1/20 0.48
STAT3 P40763 1/20 0.48
NFKB2 Q00653 1/20 0.48

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
SCHEMBL5820932 0.78 APP (0.52) PTPN1
SCHEMBL2908279 0.77 HMGCR (0.50) CYP3A4HTTMEN1KMT2ACYP1A2
SCHEMBL14283818 0.77 HMGCR (0.53) CYP3A4HTTMEN1KMT2ACYP1A2
SCHEMBL3957202 0.76 HTT (0.69) PTPN1CYP3A4HTTMEN1KMT2A
SCHEMBL11155846 0.76 PTPN1 (0.48) PTPN1CYP3A4HTTMEN1KMT2A
SCHEMBL14283785 0.75 PDE4A (0.52) CYP3A4HTTMEN1KMT2ACYP1A2
SCHEMBL24805120 0.74 POLB (0.51) PTPN1CYP3A4HTTMEN1KMT2A
SCHEMBL10908228 0.74 ALDH1A1 (0.68) PTPN1CYP3A4MEN1KMT2ACYP1A2
SCHEMBL18377199 0.74 SMPD1 (0.50) PTPN1CYP3A4HTTMEN1KMT2A
SCHEMBL23027375 0.74 CYP19A1 (0.47) PTPN1MEN1KMT2AHPGDPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7314693-B2 Electrophotographic photoconductor, electrophotographic process, electrophotographic apparatus, and process cartridge RICOH COMPANY, LTD. (JP) 2008-01-01 US disclosed
US-5043354-A Treatment of diseases caused by reactive oxygen species and organic radicals; antiischemic agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-08-27 US disclosed
EP-0398142-A1 New Benzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-11-22 EP disclosed