SCHEMBL3371680

SCHEMBL3371680

N#Cc1cnc(-c2ncc(CC(=O)NCCc3ccccc3)c(=O)[nH]2)c(O)c1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 12/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ ABCB1 P08183 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ ABCG2 Q9UNQ0 1/20 0.42
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ HSD17B2 P37059 1/20 0.40
▸ TAAR1 Q96RJ0 1/20 0.39
▸ ERCC1 P07992 1/20 0.38
▸ ERCC4 Q92889 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GLA P06280 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
SCHEMBL3368045 0.95 EGLN1 (0.65) EGLN1HPGD
SCHEMBL3369914 0.92 EGLN1 (0.71) EGLN1HPGDCA1CA2HSD17B2
SCHEMBL3368761 0.91 EGLN1 (0.60) EGLN1ERCC1ERCC4
SCHEMBL3367694 0.89 EGLN1 (0.63) EGLN1SMN1; SMN2KMT2A
SCHEMBL3366533 0.88 EGLN1 (0.57) EGLN1KMT2AGLA
SCHEMBL3368645 0.85 EGLN1 (0.67) EGLN1ERCC1ERCC4
SCHEMBL3366469 0.85 EGLN1 (0.72) EGLN1
SCHEMBL3367971 0.85 EGLN1 (0.78) EGLN1
SCHEMBL3366064 0.85 EGLN1 (0.63) EGLN1ERCC1ERCC4KMT2A
SCHEMBL3371453 0.84 EGLN1 (0.68) EGLN1HPGDCA1CA2

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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