SCHEMBL17533129

SCHEMBL17533129

Cc1ncc(C2CCN(I)CC2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 1/20 0.39
▸ DGAT1 O75907 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ KDM1A O60341 2/20 0.33
▸ NPY5R Q15761 1/20 0.31
▸ HRH1 P35367 1/20 0.31
▸ HRH4 Q9H3N8 1/20 0.31
▸ GSK3B P49841 1/20 0.30
▸ BAZ2B Q9UIF8 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
SCHEMBL15586081 0.84 F10 (0.40) F10
SCHEMBL12685102 0.83 — —
SCHEMBL15773956 0.81 F10 (0.41) F10DGAT1HRH1HRH4
SCHEMBL19521621 0.80 F10 (0.38) F10DGAT1TSHRKDM1ANPY5R
SCHEMBL19087011 0.80 NPY5R (0.41) F10DGAT1TSHRKDM1ANPY5R
SCHEMBL17571952 0.80 NPY5R (0.45) F10DGAT1TSHRKDM1ANPY5R
SCHEMBL17571954 0.78 NPY5R (0.47) F10DGAT1TSHRKDM1ANPY5R
SCHEMBL15747143 0.77 TSHR (0.36) F10DGAT1TSHRKDM1ANPY5R
SCHEMBL15586080 0.72 F10 (0.35) F10TSHRKDM1ANPY5RHRH1
SCHEMBL22693554 0.70 TSHR (0.38) F10TSHRKDM1AHRH1HRH4

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
WO-2014082379-A9 SPIRO RING COMPOUND AS HEPATITIS C VIRUS (HCV) INHIBITOR AND USES THEREOF FIELD OF THE INVENTION SUNSHINE LAKE PHARMA CO.,LTD. (CN) 2016-02-25 — — WO disclosed
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