SCHEMBL9017927

SCHEMBL9017927

CCCCCCN(C=Nc1ccncc1O)CCCCCC

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
LMNA P02545 3/20 0.33
HTT P42858 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
SERPINE1 P05121 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
POLB P06746 1/20 0.32
NAAA Q02083 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
FAAH O00519 2/20 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
SCHEMBL9017925 1.00 MAPT (0.35) MAPTLMNAHTTALDH1A1CNR1
Dimethylcarbate SCHEMBL9681187 0.92 MAPT (0.36) MAPTLMNAHTTALDH1A1POLB
Dimethylcarbate SCHEMBL9681182 0.92 MAPT (0.36) MAPTLMNAHTTALDH1A1POLB
SCHEMBL9679870 0.89
SCHEMBL9017876 0.83 MAPT (0.32) MAPTLMNAHTTALDH1A1TDP1
SCHEMBL9017915 0.82 NPSR1 (0.39) MAPTCNR1CNR2
SCHEMBL9017902 0.82 NPSR1 (0.39) MAPTCNR1CNR2
Dimethylcarbate SCHEMBL9680344 0.81 KDM6B (0.34)
SCHEMBL9017921 0.78 MAPT (0.37) MAPTLMNAHTTALDH1A1POLB
SCHEMBL9017850 0.76 ALDH1A1 (0.35) MAPTHTTALDH1A1L3MBTL1POLB

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
EP-0477903-B1 Substituted-4-amino-3-pyridinols, a process for their preparation and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1996-04-03 EP disclosed
EP-0477903-A2 Substituted-4-amino-3-pyridinols, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-04-01 EP disclosed