SCHEMBL8065204

SCHEMBL8065204

C[Zr](=Cc1ccccc1)(C1=CC=CC1)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MIF P14174 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
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
Hydrochloric Acid SCHEMBL7611887 0.99 PNMT (0.33) PNMTNPC1RAB9A
SCHEMBL7078761 0.81 PNMT (0.39) PNMTNPC1RAB9ASRD5A2
SCHEMBL868286 0.79 PNMT (0.40) PNMTNPC1RAB9AMAOASRD5A2
Hydrochloric Acid SCHEMBL28666686 0.78 PNMT (0.36) PNMTNPC1RAB9ASRD5A2
SCHEMBL9242075 0.77 RELA (0.31)
Ethane SCHEMBL8631439 0.77 PNMT (0.35) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL437016 0.76 RELA (0.30)
Hydrochloric Acid SCHEMBL5695990 0.76 PNMT (0.38) PNMTNPC1RAB9ASRD5A2
Hydrochloric Acid SCHEMBL7168372 0.76 PNMT (0.35) PNMTNPC1RAB9ASRD5A2
Hydrochloric Acid SCHEMBL217299 0.75 PNMT (0.33) PNMTNPC1RAB9A

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
EP-0572990-B2 Method for preparing ethylene copolymer MITSUI TOATSU CHEMICALS (JP) 2000-08-16 EP claimed