SCHEMBL18100469

SCHEMBL18100469

Cc1oc(C)c(-c2ccccc2)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.47
▸ BRD2 P25440 1/20 0.47
▸ PTGS1 P23219 6/20 0.45
▸ PTGS2 P35354 5/20 0.45
▸ PDGFRA P16234 1/20 0.41
▸ MAPK8 P45983 1/20 0.41
▸ CDK5 Q00535 1/20 0.41
▸ CLK4 Q9HAZ1 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ TDO2 P48775 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL14323101 0.79 PDGFRA (0.53) BRD4BRD2PTGS1PTGS2PDGFRA
SCHEMBL13791048 0.77 PTGS2 (0.41) PTGS1PTGS2ALDH1A1KDM4EMEN1
SCHEMBL5539118 0.74 BRD4 (0.45) BRD4BRD2PTGS1PTGS2PDGFRA
SCHEMBL9701635 0.73 LMNA (0.50) BRD4BRD2PTGS1PTGS2PDGFRA
SCHEMBL5145616 0.73 LMNA (0.50) BRD4BRD2PTGS1PTGS2PDGFRA
SCHEMBL12695627 0.71 MAPT (0.49) BRD4BRD2PTGS1PTGS2ALDH1A1
SCHEMBL6294085 0.71 LMNA (0.48) BRD4BRD2PTGS1PTGS2PDGFRA
SCHEMBL8618279 0.71 LMNA (0.48) BRD4BRD2PTGS1PTGS2PDGFRA
SCHEMBL27619559 0.71 LMNA (0.48) BRD4BRD2PTGS1PTGS2PDGFRA
SCHEMBL2091330 0.70 ALDH1A1 (0.44) BRD4BRD2PTGS1PTGS2PDGFRA

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
US-9634252-B2 Polymer and solar cell using the same KABUSHIKI KAISHA TOSHIBA (JP) 2017-04-25 — — US disclosed
US-20160285001-A1 POLYMER AND SOLAR CELL USING THE SAME KABUSHIKI KAISHA TOSHIBA (JP) 2016-09-29 — — US disclosed
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