SCHEMBL4704773

SCHEMBL4704773

COc1ccc(-c2cc(OC(=O)NC3CCN(C)CC3)c(NC(N)=O)s2)cc1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 16/20 0.53
▸ IKBKB O14920 1/20 0.46
▸ MAPT P10636 1/20 0.41
▸ FAAH O00519 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
SCHEMBL4704552 0.89 CHEK1 (0.60) CHEK1IKBKB
SCHEMBL4704847 0.88 CHEK1 (0.56) CHEK1IKBKBFAAH
SCHEMBL4702677 0.88 CHEK1 (0.55) CHEK1IKBKB
SCHEMBL4705794 0.86 SIGMAR1 (0.56) FAAH
SCHEMBL4704839 0.85 CHEK1 (0.55) CHEK1IKBKB
SCHEMBL4208325 0.85 CHEK1 (0.64) CHEK1
SCHEMBL4703022 0.84 CHEK1 (0.55) CHEK1
SCHEMBL4706724 0.84 CHEK1 (0.55) CHEK1
SCHEMBL4705785 0.84 CHEK1 (0.55) CHEK1
SCHEMBL4703834 0.83 CHEK1 (0.47) CHEK1IKBKB

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
EP-1660474-B1 SUBSTITUTED THIOPHENES AND USES THEREOF ASTRAZENECA AB (SE) 2008-10-29 — — EP claimed
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