SCHEMBL14611686

SCHEMBL14611686

Cn1ccnc1CCc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 1/20 0.56
MAPT P10636 1/20 0.56
HRH3 Q9Y5N1 3/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LTA4H P09960 1/20 0.49
EPHX2 P34913 1/20 0.49
F2 P00734 1/20 0.48
KCNH2 Q12809 1/20 0.48
GRIN2B Q13224 1/20 0.48
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
RAB9A P51151 1/20 0.47
BCHE P06276 3/20 0.47
MAOB P27338 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
PTGS1 P23219 1/20 0.45

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
SCHEMBL3401058 0.87 KMT2A (0.53) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL12864677 0.79 MEN1 (0.65) MAPTMEN1KMT2AKCNH2NPC1
SCHEMBL3722514 0.77 KMT2A (0.50) MEN1KMT2ANPC1
SCHEMBL16700858 0.77 KMT2A (0.48) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL31326473 0.77 MAPT (0.59) HMOX1MAPTMEN1KMT2AFFAR1
Nitric Acid SCHEMBL16700597 0.76 KMT2A (0.47) MAPTMEN1KMT2ANPC1LMNA
Trifluoroacetic Acid SCHEMBL16700179 0.75 KMT2A (0.49) MAPTMEN1KMT2ANPC1
SCHEMBL23222102 0.75 KMT2A (0.64) MAPTHRH3MEN1KMT2ANPC1
SCHEMBL6582303 0.75 LTA4H (0.59) HMOX1MAPTHRH3KMT2ALTA4H
SCHEMBL13919517 0.74 MAPT (0.65) HMOX1MAPTMEN1KMT2ALTA4H

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007022241-A2 NOVEL HIGH AFFINITY QUINOLINE-BASED KINASE LIGANDS SCHERING CORPORATION (US) 2007-02-22 WO disclosed