SCHEMBL14614656

SCHEMBL14614656

COC1=CC(C)(C(=O)Nc2cccc(-c3nc4cc(Cl)cc(Cl)c4o3)c2)CC(OC)=C1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.44
▸ P2RY14 Q15391 6/20 0.43
▸ CETP P11597 1/20 0.43
▸ HPGD P15428 3/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ DUSP1 P28562 3/20 0.40
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL2624628 0.73 HPGD (0.72) MAPTP2RY14HPGDALDH1A1GAA
SCHEMBL2624626 0.73 MAPT (0.71) MAPTP2RY14HPGDMEN1NPC1
SCHEMBL4308051 0.70 TP53 (0.55) MAPTHPGDMEN1ALDH1A1KMT2A
SCHEMBL4513646 0.68 MAPT (0.56) MAPTP2RY14MEN1KMT2ADUSP1
SCHEMBL12167405 0.67 SIRT1 (0.46) MAPTHPGDMEN1ALDH1A1KMT2A
SCHEMBL11696963 0.64 MAPT (0.47) MAPTCETPMEN1NPC1RAB9A
SCHEMBL26390953 0.63 SMN1; SMN2 (0.59) MAPTCETPHPGDMEN1NPC1
SCHEMBL28887841 0.60 P2RY14 (1.00) MAPTP2RY14HPGDMEN1NPC1
SCHEMBL30153413 0.60 P2RY14 (1.00) MAPTP2RY14HPGDMEN1NPC1
SCHEMBL2950808 0.60 ESR2 (0.62) MAPTCETPHPGDNPC1ALDH1A1

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-2007019417-A1 OXAZOLOPYRIDINE DERIVATIVES AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 — — WO disclosed
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