SCHEMBL3368645

SCHEMBL3368645

N#Cc1cnc(-c2ncc(CC(=O)NCC(=O)c3ccccc3)c(=O)[nH]2)c(O)c1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 16/20 0.67
▸ VNN1 O95497 1/20 0.35
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ ERCC1 P07992 1/20 0.34
▸ ERCC4 Q92889 1/20 0.34

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
SCHEMBL3367971 0.89 EGLN1 (0.78) EGLN1
SCHEMBL3369914 0.88 EGLN1 (0.71) EGLN1ERCC1ERCC4
SCHEMBL3371680 0.85 EGLN1 (0.67) EGLN1ERCC1ERCC4
SCHEMBL3366469 0.85 EGLN1 (0.72) EGLN1
SCHEMBL3368045 0.84 EGLN1 (0.65) EGLN1
SCHEMBL3367694 0.81 EGLN1 (0.63) EGLN1
SCHEMBL3366064 0.81 EGLN1 (0.63) EGLN1VNN1ERCC1ERCC4
SCHEMBL3371453 0.80 EGLN1 (0.68) EGLN1
SCHEMBL3368761 0.79 EGLN1 (0.60) EGLN1VNN1ERCC1ERCC4
SCHEMBL3370116 0.79 EGLN1 (0.72) 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 2 patents. 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 claimed
WO-2010018458-A2 PHENOL DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2010-02-18 — — WO disclosed
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