SCHEMBL8464437

SCHEMBL8464437

CC1=Cc2c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cccc2C1[Zr](Cl)(Cl)(C1C(C)=Cc2c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cccc21)=[Si](C)C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.34
HTR7 P34969 1/20 0.34
KDM1A O60341 1/20 0.31

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
SCHEMBL8464932 0.92 KDM1A (0.37) HTR1AHTR7KDM1A
SCHEMBL8462246 0.89 ENPP1 (0.31)
SCHEMBL8465340 0.86 HTR1A (0.33) HTR1AHTR7
SCHEMBL8463229 0.86
SCHEMBL15329377 0.85
SCHEMBL5837577 0.84 HTR1A (0.34) HTR1AHTR7
SCHEMBL15329446 0.84 IKBKB (0.33) KDM1A
SCHEMBL8463656 0.83 EDNRB (0.35)
SCHEMBL8206244 0.82 HTR1A (0.36) HTR1AHTR7KDM1A
SCHEMBL338922 0.81 PDCD1 (0.30)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5859272-A METALLOCENES; PRODUCES POLYOLEFINS HAVING A HIGH MELTING POINT AND A HIGH MOLECULAR WEIGHT; HIGH POLYMERIZATION ACTIVITY MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1999-01-12 US disclosed
US-5616663-A TRANSITION METAL COMPOUND, ALUMINOXANE, COMPOUND WHICH REACTS WITH TRANSITION METAL COMPOUND TO FORM ION PAIR MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-04-01 US disclosed