SCHEMBL16848484

SCHEMBL16848484

Nc1ccc(-n2c3c(c4ccccc42)CCCC3O)cc1-n1c2c(c3ccccc31)CCCC2O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.38
▸ ALDH1A1 P00352 4/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ BRD3 Q15059 1/20 0.35
▸ TBXA2R P21731 1/20 0.33
▸ PTGDR Q13258 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ NR3C1 P04150 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ MAPT P10636 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ S100B P04271 1/20 0.31
▸ GAA P10253 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
SCHEMBL16848475 0.85 MAPT (0.39) ACHEALDH1A1MEN1KMT2AHPGD
SCHEMBL16848483 0.81 HSD17B10 (0.42) ALDH1A1MEN1KMT2AHSD17B10CYP1A2
SCHEMBL25104929 0.79 KDM4E (0.44) ACHEALDH1A1MEN1KMT2AHPGD
SCHEMBL21524759 0.75 BRD1 (0.34) ALDH1A1MEN1KMT2AHPGDCYP1A2
SCHEMBL4967660 0.69 KDM4E (0.46) ALDH1A1MEN1KMT2AHPGDHSD17B10
SCHEMBL14142098 0.68 MEN1 (0.43) ACHEALDH1A1MEN1KMT2AHPGD
SCHEMBL13624634 0.66 HTR6 (0.51) ACHEBRD3HTR6
SCHEMBL25985760 0.64 KDM4E (0.40) ALDH1A1MEN1KMT2AHPGDHSD17B10
SCHEMBL16848488 0.64 HTR6 (0.44) ALDH1A1MEN1KMT2AHSD17B10TSHR
SCHEMBL16848480 0.64 MAPT (0.35) ALDH1A1MEN1KMT2AHPGDHSD17B10

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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