SCHEMBL14098202

SCHEMBL14098202

C[Si](C)(C)CCc1ccc2c(c1)CCc1c(O)cc(O)cc1O2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 1/20 0.33
▸ PTGS2 P35354 2/20 0.32
▸ CALM1 P0DP23 1/20 0.31
▸ MAPKAPK2 P49137 1/20 0.31
▸ SLC28A3 Q9HAS3 1/20 0.31

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
SCHEMBL14098195 0.86 SLC28A3 (0.37) CTSBPTGS2CALM1MAPKAPK2SLC28A3
SCHEMBL14098220 0.84 CALM1 (0.38) CALM1SLC28A3
SCHEMBL5100866 0.83 PTGS2 (0.42) PTGS2
SCHEMBL14098102 0.82 MAPKAPK2 (0.36) PTGS2MAPKAPK2
SCHEMBL7115337 0.79 AKR1B1 (0.47) —
SCHEMBL5107101 0.74 AHR (0.39) PTGS2MAPKAPK2
SCHEMBL7116087 0.74 SMN1; SMN2 (0.42) PTGS2MAPKAPK2
SCHEMBL7111884 0.74 MAPKAPK2 (0.35) PTGS2MAPKAPK2
SCHEMBL7112263 0.74 AHR (0.39) PTGS2MAPKAPK2
SCHEMBL14098209 0.73 CALM1 (0.38) CALM1SLC28A3

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
US-7410997-B2 Tricyclic fused heterocycle compounds, process for preparing the same and use thereof NIPPON SULSAN KAISHA, LTD. (JP) 2008-08-12 — — US disclosed
US-7410997-B2 Tricyclic fused heterocycle compounds, process for preparing the same and use thereof NIPPON SULSAN KAISHA, LTD. (JP) 2008-08-12 — — US disclosed
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