SCHEMBL7777419

SCHEMBL7777419

CCOC(=O)C1=Cc2cccc(O[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)c2CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
ALDH1A1 P00352 5/20 0.35
HPGD P15428 3/20 0.35
KDM4E B2RXH2 3/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.34
MAPT P10636 5/20 0.34
GAA P10253 5/20 0.33
ACHE P22303 1/20 0.33
TSHR P16473 1/20 0.33
CRHBP P24387 1/20 0.33
KMT2A Q03164 1/20 0.33
CRHR2 Q13324 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
PTGIR P43119 1/20 0.32
AURKA O14965 1/20 0.32
MAPK10 P53779 1/20 0.32
RIPK1 Q13546 1/20 0.32
RAB9A P51151 2/20 0.32

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
SCHEMBL7717824 0.82 CA12 (0.38) ALDH1A1HPGDKDM4EMAPTGAA
SCHEMBL7779651 0.80 PTGIR (0.35) PTGIR
SCHEMBL7708834 0.78 CA12 (0.42) ALDH1A1KDM4ECYP1A2MAPTACHE
SCHEMBL7717808 0.76 PTGIR (0.31) PTGIR
SCHEMBL7776701 0.75 PTGIR (0.37) PTGIRCHRM4CHRM5CHRM1CHRM3
SCHEMBL8485232 0.73 PTGIR (0.38) PTGIRCHRM4CHRM5CHRM1CHRM3
SCHEMBL7772446 0.71 PTGIR (0.38) ALDH1A1KDM4EGAATSHRPTGIR
SCHEMBL7772413 0.71 MAPT (0.37) KDM4ECYP1A2MAPTACHETSHR
SCHEMBL7779781 0.71 ALDH1A1 (0.37) ALDH1A1HPGDKDM4ETP53MAPT
SCHEMBL7718275 0.71 PTGIR (0.36) PTGIRCHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0749424-B1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-12 EP disclosed
US-5863918-A HYPOTENSIVE AGENTS, ANTICOAGULANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-01-26 US disclosed
US-5763489-A ANTICOAGULANTS AND HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-09 US disclosed
EP-0749424-A1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-12-27 EP disclosed
WO-1995024393-A1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-09-14 WO disclosed