SCHEMBL903693

SCHEMBL903693

CCC1Oc2cc(B3OC(C)(C)C(C)(C)O3)ccc2-c2cc3cc(Cl)ccc3n21

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.32
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 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
SCHEMBL19318922 0.83 LPL (0.36) EGFRLPLLIPG
SCHEMBL10215056 0.82 SNCA (0.31)
SCHEMBL903814 0.80 EGFR (0.36) EGFRLPLLIPG
SCHEMBL903791 0.80 PIK3CA (0.33)
SCHEMBL15898090 0.79
SCHEMBL18061906 0.78 ACLY (0.34) EGFRLPLLIPG
SCHEMBL18057080 0.76 LPL (0.36) LPLLIPGPRMT5WDR77
SCHEMBL903402 0.76 LPL (0.36) LPLLIPGPRMT5WDR77
SCHEMBL10217790 0.74 SNCA (0.33) LPLLIPG
SCHEMBL19226001 0.70 LPL (0.31) LPLLIPG

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-2012041014-A1 TETRACYCLIC INDOLE DERIVATIVES FOR TREATING HEPATITIS C VIRUS INFECTION MERCK SHARP & DOHME CORP. (US) 2012-04-05 WO disclosed