SCHEMBL6870028

SCHEMBL6870028

Cc1ccccc1N[Hf](Cl)(Cl)(c1cccc2c1Cc1ccccc1-2)[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PNMT P11086 1/20 0.32
PGR P06401 1/20 0.31
EIF2AK1 Q9BQI3 1/20 0.31
TP53 P04637 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
SCHEMBL7107706 0.90 NPC1 (0.34) NPC1RAB9APNMTPGREIF2AK1
SCHEMBL7092703 0.86 NPC1 (0.37) NPC1RAB9APNMT
SCHEMBL6827121 0.86 EGFR (0.39) NPC1RAB9APNMT
SCHEMBL6861249 0.84 PNMT (0.35) NPC1RAB9APNMT
SCHEMBL6830302 0.84 NPC1 (0.33) NPC1RAB9APNMTPGR
SCHEMBL5853876 0.81 RAB9A (0.39) NPC1RAB9A
SCHEMBL6702089 0.80 EGFR (0.33) NPC1RAB9APNMT
SCHEMBL5853365 0.80 NPC1 (0.38) NPC1RAB9A
SCHEMBL6865138 0.78 PNMT (0.35) NPC1RAB9APNMT
SCHEMBL5855903 0.78 NPC1 (0.48) NPC1RAB9APNMT

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