SCHEMBL5961785

SCHEMBL5961785

CCOc1ccc(C(=O)Oc2ccc(C3CCC(C)CC3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
CCNC P24863 2/20 0.49
CDK8 P49336 2/20 0.49
LMNA P02545 2/20 0.47
MAPT P10636 4/20 0.46
THRB P10828 1/20 0.46
PARP10 Q53GL7 1/20 0.44
RAB9A P51151 1/20 0.43
ESR2 Q92731 1/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HPGD P15428 2/20 0.42
NPC1 O15118 1/20 0.42
PLK1 P53350 1/20 0.42
SCN1A P35498 1/20 0.42
SCN2A Q99250 1/20 0.42
SCN3A Q9NY46 1/20 0.42
KDM4E B2RXH2 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL11412571 1.00 KMT2A (0.53) KMT2ACCNCCDK8LMNAMAPT
SCHEMBL18635922 0.90 ESR2 (0.51) KMT2ALMNAMAPTPARP10ESR2
SCHEMBL11405311 0.90 KMT2A (0.50) KMT2ALMNAMAPTRAB9AALDH1A1
SCHEMBL11416222 0.90 KMT2A (0.56) KMT2ALMNAMAPTTHRBRAB9A
SCHEMBL11411199 0.88 KMT2A (0.52) KMT2ACCNCCDK8LMNAMAPT
SCHEMBL11406143 0.88 ESR2 (0.44) KMT2ALMNAMAPTRAB9AESR2
SCHEMBL11299893 0.88 MAPT (0.55) KMT2ACCNCCDK8LMNAMAPT
SCHEMBL11418370 0.88 ESR2 (0.44) KMT2ALMNAMAPTRAB9AESR2
SCHEMBL11409999 0.88 LMNA (0.58) KMT2ALMNAMAPTTHRBRAB9A
SCHEMBL11406487 0.87 KMT2A (0.50) KMT2ALMNAMAPTRAB9AESR2

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-8168734-B2 Lateral alpha-substituted acrylate compound and polymer thereof JNC CORPORATION (JP) 2012-05-01 US disclosed
US-7157124-B2 Polymerizable compounds and their polymers CHISSO PETROCHEMICAL CORPORATION (JP) 2007-01-02 US disclosed