SCHEMBL8440133

SCHEMBL8440133

CCCCCCCCCCC[C@H](CCO[Si](C)(C)C(C)(C)C)OCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CETP P11597 3/20 0.36
CSNK1E P49674 1/20 0.36
PLA2G10 O15496 1/20 0.36
PLA2G2A P14555 1/20 0.36
CTRC Q99895 1/20 0.34
TLR2 O60603 1/20 0.34
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 0.33

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
SCHEMBL25967589 0.82 PLA2G2A (0.43) PLA2G10PLA2G2ATLR2
SCHEMBL10043029 0.82 PLA2G2A (0.43) PLA2G10PLA2G2ATLR2
SCHEMBL22406078 0.81 PLA2G10 (0.38) CETPCSNK1EPLA2G10PLA2G2ACTRC
SCHEMBL28998085 0.80 CETP (0.45) CETPCSNK1ECTRC
SCHEMBL29770041 0.80 CA2 (0.33) CSNK1E
SCHEMBL29770034 0.80 CA2 (0.33) CSNK1E
SCHEMBL29770030 0.80 CA2 (0.33) CSNK1E
SCHEMBL16830095 0.80 CA2 (0.33) CSNK1E
SCHEMBL27089882 0.78 L3MBTL1 (0.40) CETPCSNK1EPLA2G10PLA2G2ATLR2
SCHEMBL31411073 0.78 BTN3A1 (0.35)

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-0639977-A4 LIPID-A ANALOGS: NEW MONOSACCHARIDE AND DISACCHARIDE INTERMEDIATES FOR ELICITING THERAPEUTIC ANTIBODIES AND FOR ANTITUMOR AND ANTIVIRAL ACTIVITIES. IGEN INC (US) 1999-04-14 EP disclosed
US-5597573-A ADMINISTERING AS AN IMMUNOGEN IGEN, INC. (US) 1997-01-28 US disclosed
US-5593969-A TREATMENT OF SEPTICEMIA IGEN INCORPORATED (US) 1997-01-14 US disclosed
EP-0639977-A1 LIPID-A ANALOGS: NEW MONOSACCHARIDE AND DISACCHARIDE INTERMEDIATES FOR ELICITING THERAPEUTIC ANTIBODIES AND FOR ANTITUMOR AND ANTIVIRAL ACTIVITIES IGEN, INC. (US) 1995-03-01 EP disclosed
WO-1993019761-A1 LIPID-A ANALOGS: NEW MONOSACCHARIDE AND DISACCHARIDE INTERMEDIATES FOR ELICITING THERAPEUTIC ANTIBODIES AND FOR ANTITUMOR AND ANTIVIRAL ACTIVITIES IGEN, INC. (US) 1993-10-14 WO disclosed