SCHEMBL7928034

SCHEMBL7928034

CCCC1=C([Hf]c2cccc3c2Cc2ccccc2-3)CC=C1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.37
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
Butane SCHEMBL7921919 0.99 PNMT (0.36) PNMTNPC1RAB9A
Butane SCHEMBL7930680 0.73 PNMT (0.39) PNMTNPC1RAB9A
Iodide SCHEMBL7930583 0.72 PNMT (0.36) PNMTNPC1RAB9A
Butane SCHEMBL7929221 0.72 PNMT (0.36) PNMTNPC1RAB9A
Iodide SCHEMBL7935539 0.72 PNMT (0.36) PNMTNPC1RAB9A
Butane SCHEMBL7928031 0.72 PNMT (0.36) PNMTNPC1RAB9A
Iodide SCHEMBL7931462 0.72 PNMT (0.36) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL1116208 0.72 PNMT (0.36) PNMTNPC1RAB9A
SCHEMBL620545 0.72
Fluoride SCHEMBL1130450 0.70

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-6180736-B1 USING SUPPORT AND A COMPLEX FORMED BY ACTIVATING A GROUP 3, 4, 5, OR 6 METALLOCENE COMPRISING UNSUBSTITUTED (TETRAHYDRO) INDENYL LIGAND AND UNSUBSTITUTED CYCLOPENTADIENYL LIGAND; ETHYLENE POLYMERS WITH NARROW MOLECULAR WEIGHT DISTRIBUTION EXXON CHEMICAL PATENTS INC 2001-01-30 US disclosed