SCHEMBL7788978

SCHEMBL7788978

CCCCO[Ti](Cl)(OCC)OCCCC

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL236198 0.92 ADRB2 (0.41) ADRB2ADRB1ADRB3CYP3A4TSHR
SCHEMBL4298222 0.84 THRB (0.37) TSHRALDH1A1CA1CA2
SCHEMBL4299499 0.82 THRB (0.42) TSHRALDH1A1CA1CA2
SCHEMBL28563875 0.82 THRB (0.42) TSHRALDH1A1CA1CA2
SCHEMBL10937417 0.82 THRB (0.42) TSHRALDH1A1CA1CA2
SCHEMBL232157 0.81
SCHEMBL28410843 0.78
SCHEMBL10535776 0.76 ADRB2 (0.33) ADRB2ADRB1ADRB3CYP3A4TSHR
SCHEMBL236054 0.76
SCHEMBL234591 0.76 ADRB2 (0.41) ADRB2ADRB1ADRB3CYP3A4TSHR

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
EP-0419116-B1 Method for the preparation of a stabilized catalyst and its introduction into a polymerization vessel for the polymerization of olefins IDEMITSU PETROCHEMICAL CO (JP) 2001-11-21 EP disclosed
US-5296430-A Method for the preparation of a stabilized catalyst for the polymerization of olefins IDEMITSU PETROCHEMICAL COMPANY, LTD. (JP) 1994-03-22 US disclosed
EP-0419116-A2 Method for the preparation of a stabilized catalyst for the polymerization of olefins IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1991-03-27 EP disclosed