SCHEMBL5716522

SCHEMBL5716522

CCCCCCCCOc1ccc(-c2nc(-c3ccc(-c4ccccc4)cc3)cc(-c3ccc(-c4ccccc4)cc3)n2)c(O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.54
RARB P10826 3/20 0.49
NR5A1 Q13285 1/20 0.47
PTPN1 P18031 1/20 0.46
PLA2G2A P14555 1/20 0.46
DHODH Q02127 1/20 0.46
IDH1 O75874 1/20 0.46
LTB4R Q15722 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP19A1 P11511 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL19358328 0.98 PTPN11 (0.56) PTPN11RARBNR5A1PTPN1PLA2G2A
SCHEMBL10090891 0.92 PTPN11 (0.52) PTPN11RARBNR5A1PTPN1
SCHEMBL31425691 0.92 PTPN11 (0.52) PTPN11RARBNR5A1PTPN1
SCHEMBL5550301 0.92 PTPN11 (0.52) PTPN11RARBNR5A1PTPN1
SCHEMBL1630438 0.92 PTPN11 (0.52) PTPN11RARBNR5A1PTPN1
SCHEMBL10090875 0.92 PTPN11 (0.52) PTPN11RARBNR5A1PTPN1
SCHEMBL9635563 0.91 PTPN11 (0.54) PTPN11RARBNR5A1PTPN1PLA2G2A
SCHEMBL6017413 0.89 PTPN11 (0.51) PTPN11RARBNR5A1IDH1CYP1A2
SCHEMBL1468260 0.89 PTPN11 (0.54) PTPN11RARBNR5A1PTPN1
SCHEMBL7887565 0.89 PTPN11 (0.54) PTPN11RARBNR5A1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1627011-A2 HIGHLY COMPATIBLE AND NON-MIGRATORY POLYMERIC UV-ABSORBER Ciba SC Holding AG (CH) 2006-02-22 EP disclosed
WO-2004104081-A2 HIGHLY COMPATIBLE AND NON-MIGRATORY POLYMERIC UV-ABSORBER CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-12-02 WO disclosed