SCHEMBL28973379

SCHEMBL28973379

CC(C)(C)N[Ti](C)(C)C1c2ccccc2-c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.36
HTR2A P28223 2/20 0.36
KMT2A Q03164 3/20 0.33
ACHE P22303 3/20 0.33
POLB P06746 2/20 0.33
BCHE P06276 2/20 0.33
MEN1 O00255 2/20 0.33
ATM Q13315 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
CHRM2 P08172 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
CHRM1 P11229 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
SCHEMBL4558375 0.98 GPR3 (0.35) GPR3HTR2AKMT2AACHEPOLB
SCHEMBL8522938 0.90 POLB (0.33) GPR3HTR2AKMT2APOLBHDAC3
Butadiene SCHEMBL8524026 0.90 GPR3 (0.31) GPR3HTR2A
SCHEMBL8523391 0.85
SCHEMBL821476 0.83
Butadiene SCHEMBL83948 0.77
SCHEMBL87654 0.77
SCHEMBL5611100 0.74
Hydrochloric Acid SCHEMBL7199550 0.74 ALDH1A1 (0.34) KMT2AMEN1
SCHEMBL7867045 0.73 MAOB (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025000320-A1 METHOD FOR PREPARING POLYOLEFIN BY MEANS OF CASCADE POLYMERIZATION 浙江大学衢州研究院 2025-01-02 WO claimed
CN-115850586-A Comb-shaped ethylene-propylene copolymer, cross-linked comb-shaped ethylene-propylene copolymer and preparation method thereof 浙江大学 2023-03-28 CN claimed
WO-2022133849-A1 METHOD FOR PREPARING SUPPORTED OLEFIN POLYMERIZATION CATALYST, RESULTING CATALYST AND APPLICATION THEREOF 浙江大学 2022-06-30 WO disclosed