SCHEMBL13402131

SCHEMBL13402131

CCCCCC(=O)Oc1ccc(OCCCC2CCC(OCCCCCCOc3ccc(-c4ccc(OCCCC)cc4)cc3)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
KMT2A Q03164 1/20 0.44
ESR1 P03372 3/20 0.43
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
PLA2G4B P0C869 2/20 0.42
ITGB3 P05106 1/20 0.42
ITGA2B P08514 1/20 0.42
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41

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
SCHEMBL10311584 0.90 RARB (0.42) RARBESR1HDAC3HDAC4HDAC1
SCHEMBL13402021 0.86 KMT2A (0.48) SMN1; SMN2KMT2AESR1PLA2G4BTP53
SCHEMBL13402155 0.84 RARB (0.41) RARBITGB3ITGA2BCNR2
SCHEMBL10540387 0.83 RARB (0.64) RARBSMN1; SMN2KMT2AESR1HDAC3
SCHEMBL9157429 0.81 SMN1; SMN2 (0.44) RARBSMN1; SMN2KMT2AESR1ITGB3
SCHEMBL11276110 0.79 KMT2A (0.48) SMN1; SMN2KMT2AESR1NPC1LMNA
SCHEMBL11280516 0.79 KMT2A (0.48) SMN1; SMN2KMT2AESR1NPC1LMNA
SCHEMBL11280797 0.79 KMT2A (0.48) SMN1; SMN2KMT2AESR1NPC1LMNA
SCHEMBL11285774 0.79 KMT2A (0.48) SMN1; SMN2KMT2AESR1NPC1LMNA
SCHEMBL11283806 0.79 KMT2A (0.48) SMN1; SMN2KMT2AESR1NPC1LMNA

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