SCHEMBL7911396

SCHEMBL7911396

CC(C)C(C(C)C)=[Ti](C1=CC=CC1)C1c2ccccc2-c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 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
SCHEMBL6271161 0.84 POLB (0.33) POLB
Hydrochloric Acid SCHEMBL7641166 0.82 POLB (0.33) POLB
SCHEMBL8469128 0.81 POLB (0.33) POLB
SCHEMBL8769044 0.80 MEN1 (0.30) MEN1KMT2A
Hydrochloric Acid SCHEMBL8380795 0.79
SCHEMBL6675331 0.78 MEN1 (0.32) MEN1POLBKMT2AATM
Hydrochloric Acid SCHEMBL8465909 0.77 MEN1 (0.31) MEN1POLBKMT2AATM
Methyl Alcohol SCHEMBL8155091 0.72
SCHEMBL6272387 0.72 GPR3 (0.31)
SCHEMBL8169459 0.72 GPR3 (0.31)

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-6214946-B1 GAS PHASE ETHYLENE-PROPYLENE-DIENE RUBBER PRODUCTION EMPLOYING AN INERT PARTICULATE MATERIAL (WHICH IS PASSIVATED BY PRETREATMENT WITH TRIALKYLALUMINUM COMPOUND), AND A SINGLE-SITE (E.G., METALLOCENE) CATALYST. UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2001-04-10 US disclosed