SCHEMBL5752697

SCHEMBL5752697

COC/C=C/c1c(Br)n(COCC[Si](C)(C)C)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.44
▸ EGFR P00533 1/20 0.32
▸ IGF1R P08069 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ FLT4 P35916 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ EPHB4 P54760 1/20 0.32
▸ TEK Q02763 1/20 0.32
▸ PTGER4 P35408 2/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL23538108 0.68 EGFR (0.45) NPC1EGFRIGF1RSRCFLT4
SCHEMBL3781505 0.67 DYRK1A (0.37) NPC1EGFRIGF1RSRCFLT4
SCHEMBL31662605 0.67 NPC1 (0.47) NPC1EGFRIGF1RSRCFLT4
SCHEMBL31300632 0.67 NPC1 (0.49) NPC1PTGER4KMT2A
SCHEMBL20604916 0.67 NPC1 (0.49) NPC1PTGER4KMT2A
SCHEMBL1119311 0.67 MPO (0.41) NPC1EGFRIGF1RSRCFLT4
SCHEMBL6259455 0.66 NPC1 (0.42) NPC1
SCHEMBL16023365 0.66 NPC1 (0.42) NPC1EGFRIGF1RSRCFLT4
SCHEMBL29520372 0.66 NPC1 (0.42) NPC1
SCHEMBL26675951 0.65 MAOA (0.40) NPC1EGFRIGF1RSRCFLT4

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
EP-1699762-A1 5-AMINO-4-HYDROXY-7-(1H-INDOLMETHYL)-8-METHYLNONAMIDE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION Speedel Experimenta AG (CH) 2006-09-13 — — EP disclosed
WO-2005090305-A1 5-AMINO-4-HYDROXY-7-(1H-INDOLMETHYL)-8-METHYLNONAMIDE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION SPEEDEL EXPERIMENTA AG (CH) 2005-09-29 — — WO disclosed
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