SCHEMBL13402155

SCHEMBL13402155

CCCCCC(=O)Oc1ccc(OCCCc2ccc(-c3ccc(OCCCCCCOC4CCC(CCCC)CC4)c(F)c3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.41
RARA P10276 2/20 0.41
S1PR1 P21453 2/20 0.41
RARG P13631 1/20 0.39
ITGB3 P05106 2/20 0.38
ITGA2B P08514 2/20 0.38
CNR2 P34972 7/20 0.38
CNR1 P21554 6/20 0.38
FAAH O00519 1/20 0.37
CYSLTR2 Q9NS75 1/20 0.37
PTPN1 P18031 1/20 0.36
PTPN6 P29350 1/20 0.36
PTPN11 Q06124 1/20 0.36
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
S1PR4 O95977 1/20 0.36
S1PR3 Q99500 1/20 0.36

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
SCHEMBL10311603 0.93 RARB (0.40) RARBRARAS1PR1RARGITGB3
SCHEMBL13402139 0.87 S1PR1 (0.41) RARBRARAS1PR1RARGITGB3
SCHEMBL13402131 0.84 RARB (0.46) RARBITGB3ITGA2BCNR2
SCHEMBL9479205 0.80 THRA (0.51) RARBRARAS1PR1PTPN1PTPN6
SCHEMBL9475902 0.80 THRA (0.51) RARBRARAS1PR1PTPN1PTPN6
SCHEMBL9476333 0.80 THRA (0.51) RARBRARAS1PR1PTPN1PTPN6
SCHEMBL9476687 0.80 THRA (0.51) RARBRARAS1PR1PTPN1PTPN6
SCHEMBL9479168 0.80 THRA (0.51) RARBRARAS1PR1PTPN1PTPN6
SCHEMBL9477118 0.80 THRA (0.51) RARBRARAS1PR1PTPN1PTPN6
SCHEMBL9652131 0.80 THRA (0.51) RARBRARAS1PR1PTPN1PTPN6

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-7705105-B2 A cyclic polymer of silsesquioxane skeleton with side chains formed byhydrosilation of an unsaturated end group containing an active polymerfunctional group; polyimidesiloxane copolymers; polyestersiloxane copolymers; high molecular weight; thin films; strength; heat resistance;waterproofing; CHISSO PETROCHEMICAL CORPORATION (JP) 2010-04-27 US disclosed
US-20070190344-A1 Verification of translation JNC CORPORATION (JP) 2007-08-16 US disclosed