SCHEMBL7104430

SCHEMBL7104430

CC(C)(C)c1cccc(N[Hf](Cl)(Cl)(c2cccc3c2Cc2ccccc2-3)[SiH](c2ccccc2)c2ccccc2)c1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNK18 Q7Z418 1/20 0.33
MAPK14 Q16539 1/20 0.32
STK10 O94804 1/20 0.31
SLK Q9H2G2 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
PDGFRB P09619 1/20 0.30
EGFR P00533 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
SCHEMBL6861249 0.87 PNMT (0.35) NPC1RAB9APDGFRBEGFR
SCHEMBL5854687 0.82 MAPK14 (0.37) MAPK14NPC1RAB9A
SCHEMBL7092703 0.81 NPC1 (0.37) NPC1RAB9A
SCHEMBL7107706 0.78 NPC1 (0.34) NPC1RAB9A
SCHEMBL6830302 0.78 NPC1 (0.33) NPC1RAB9A
SCHEMBL6870028 0.78 NPC1 (0.39) NPC1RAB9A
SCHEMBL6702089 0.76 EGFR (0.33) NPC1RAB9AEGFR
SCHEMBL5853386 0.76 NPC1 (0.40) NPC1RAB9A
SCHEMBL6827121 0.75 EGFR (0.39) NPC1RAB9AEGFR
SCHEMBL5855903 0.74 NPC1 (0.48) NPC1RAB9A

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-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed