SCHEMBL6837569

SCHEMBL6837569

C[Si](C)=[Zr]c1c(C2=CC=CC2)ccc2c1Cc1ccccc1-2

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PGR P06401 1/20 0.32
SRD5A2 P31213 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
SCHEMBL698266 0.83 NPC1 (0.39) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL3687435 0.82 PNMT (0.33) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL2505648 0.82 PNMT (0.33) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL7195348 0.79 SRD5A2 (0.36) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL27348144 0.78 PNMT (0.45) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL28286932 0.77 PNMT (0.44) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL28220071 0.77 PNMT (0.44) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL6211217 0.77 PNMT (0.33) PNMT
SCHEMBL9659755 0.76 PNMT (0.37) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL28762096 0.76 PNMT (0.37) PNMTNPC1RAB9APGRSRD5A2

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
US-6753378-B2 GRAFTED WITH CARBOXYL- OR ANHYDRIDE CONTAINING COMPOUND; MELT PROCESSABILITY, CHEMICAL RESISTANCE, ELECTRICAL AND MECHANICAL PROPERTIES; INJECTION AND BLOW MOLDING; FILMS, SHEETS MITSUI CHEMICALS, INC. (JP) 2004-06-22 US disclosed