SCHEMBL16338927

SCHEMBL16338927

Cc1c(C(=O)O)cncc1N1CCC2(CC1)CNCN2

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 2/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ TTR P02766 1/20 0.30

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
SCHEMBL4261268 0.79 ACVR1 (0.42) —
SCHEMBL16338929 0.75 PTGER4 (0.43) TTR
SCHEMBL16338928 0.74 CCR5 (0.32) TTR
SCHEMBL18914011 0.65 HCAR2 (0.46) —
SCHEMBL6577587 0.60 GABRP (0.42) —
SCHEMBL15152162 0.59 MEN1 (0.45) TTR
SCHEMBL6138291 0.59 OPRM1 (0.35) —
SCHEMBL31118132 0.59 HCAR2 (0.41) —
Hydrochloric Acid SCHEMBL11682177 0.59 GABRP (0.41) —
SCHEMBL30686350 0.57 LATS1 (0.50) —

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
US-8921555-B2 Substituted-1,3,8-triazaspiro[4.5]decane-2,4-diones MERCK SHARP & DOHME CORP. (US) 2014-12-30 — — US disclosed
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