SCHEMBL16848475

SCHEMBL16848475

Nc1ccc(-n2c3c(c4cc(Cl)ccc42)CCCC3O)cc1-n1c2c(c3cc(Cl)ccc31)CCCC2O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ HSD17B10 Q99714 3/20 0.36
▸ USP2 O75604 2/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TBXA2R P21731 3/20 0.33
▸ SIRT1 Q96EB6 5/20 0.33
▸ SIRT2 Q8IXJ6 3/20 0.33
▸ SIRT3 Q9NTG7 2/20 0.33
▸ MAPK1 P28482 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ PTGDR Q13258 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL16848484 0.85 ACHE (0.38) MAPTALDH1A1LMNAGAAHSD17B10
SCHEMBL16848483 0.83 HSD17B10 (0.42) MAPTKDM4EALDH1A1LMNAGAA
SCHEMBL16848482 0.80 USP2 (0.31) HSD17B10USP2
SCHEMBL4972027 0.75 MAPT (0.46) MAPTKDM4EALDH1A1LMNAGAA
SCHEMBL25104929 0.71 KDM4E (0.44) MAPTKDM4EALDH1A1GAAHSD17B10
SCHEMBL4966957 0.71 KDM4E (0.45) MAPTKDM4EALDH1A1LMNAGAA
SCHEMBL4972329 0.71 KDM4E (0.42) MAPTKDM4EALDH1A1LMNAGAA
SCHEMBL4968337 0.71 MAPT (0.44) MAPTKDM4EALDH1A1LMNAGAA
SCHEMBL4970200 0.69 MAPT (0.43) MAPTKDM4EALDH1A1LMNAGAA
SCHEMBL4971672 0.67 HTR6 (0.43) MAPTKDM4EALDH1A1LMNAGAA

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-20150179714-A1 Crosslinkable, /Polymerizable and Combinations Thereof Charge-transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications and Mothod of Making Same. Molaire Consulting 2015-06-25 — — US disclosed
US-20150179714-A1 Crosslinkable, /Polymerizable and Combinations Thereof Charge-transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications and Mothod of Making Same. Molaire Consulting 2015-06-25 — — US disclosed
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