SCHEMBL3369812

SCHEMBL3369812

Cc1c(C#N)cnc(-c2nc(CC(=O)NCC3CC3)cs2)c1O

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 18/20 0.69
▸ CNR1 P21554 1/20 0.36

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
SCHEMBL3368312 0.88 EGLN1 (0.77) EGLN1
SCHEMBL3370710 0.87 EGLN1 (0.67) EGLN1
SCHEMBL3368764 0.84 EGLN1 (0.69) EGLN1
SCHEMBL3368198 0.82 EGLN1 (1.00) EGLN1
SCHEMBL3368117 0.81 EGLN1 (0.75) EGLN1
SCHEMBL3368118 0.81 EGLN1 (0.64) EGLN1
SCHEMBL3370372 0.80 EGLN1 (1.00) EGLN1
SCHEMBL3367691 0.78 EGLN1 (0.66) EGLN1
SCHEMBL3367998 0.77 EGLN1 (0.67) EGLN1
SCHEMBL3371813 0.71 EGLN1 (1.00) 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
Send feedback