SCHEMBL3367694

SCHEMBL3367694

N#Cc1cnc(-c2ncc(CC(=O)NCCc3ccccn3)c(=O)[nH]2)c(O)c1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 13/20 0.63
▸ MAPK1 P28482 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.39
▸ F2 P00734 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL3371680 0.89 EGLN1 (0.67) EGLN1SMN1; SMN2KMT2A
SCHEMBL3368761 0.85 EGLN1 (0.60) EGLN1
SCHEMBL3368045 0.85 EGLN1 (0.65) EGLN1
SCHEMBL3369914 0.84 EGLN1 (0.71) EGLN1ALDH1A1
SCHEMBL3371453 0.82 EGLN1 (0.68) EGLN1ALDH1A1
SCHEMBL3368645 0.81 EGLN1 (0.67) EGLN1
SCHEMBL3366533 0.81 EGLN1 (0.57) EGLN1MEN1KMT2ARAB9A
SCHEMBL3366469 0.81 EGLN1 (0.72) EGLN1
SCHEMBL3366064 0.81 EGLN1 (0.63) EGLN1MEN1KMT2AALDH1A1
SCHEMBL3367971 0.81 EGLN1 (0.78) EGLN1

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-2010018458-A2 PHENOL DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2010-02-18 — — WO disclosed
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