SCHEMBL3385648

SCHEMBL3385648

F[Ti](F)(F)(c1ccccc1)C1C=Cc2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.33
HTR2A P28223 1/20 0.33
SIGMAR1 Q99720 4/20 0.31
BRD4 O60885 1/20 0.31
CCL2 P13500 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
SCHEMBL3381833 0.78 HTR6 (0.33) HTR6HTR2ASIGMAR1BRD4CCL2
SCHEMBL3385102 0.78 HTR6 (0.33) HTR6HTR2ASIGMAR1BRD4CCL2
SCHEMBL3385138 0.78 HTR6 (0.33) HTR6HTR2ASIGMAR1BRD4CCL2
SCHEMBL3382736 0.77 BRD4 (0.36) HTR6HTR2ASIGMAR1BRD4CCL2
Hydrochloric Acid SCHEMBL4470962 0.76 HTR6 (0.33) HTR6HTR2ASIGMAR1BRD4CCL2
SCHEMBL8755002 0.76 HTR6 (0.33) HTR6HTR2ASIGMAR1BRD4CCL2
SCHEMBL7630353 0.75 SIGMAR1 (0.33) HTR6HTR2ASIGMAR1BRD4CCL2
Hydrochloric Acid SCHEMBL8605232 0.74 SIGMAR1 (0.32) HTR6HTR2ASIGMAR1BRD4CCL2
SCHEMBL7628486 0.74 SIGMAR1 (0.32) HTR6HTR2ASIGMAR1BRD4CCL2
SCHEMBL1130888 0.73 BRD4 (0.33) HTR6HTR2ASIGMAR1BRD4CCL2

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-7709586-B2 Olefin polymerization catalyst and olefin polymerization process using the same DAELIM INDUSTRIAL CO., LTD. (KR) 2010-05-04 US disclosed
US-20070142221-A1 Olefin polymerization catalyst and olefin polymerization process using the same DAELIM INDUSTRIAL CO., LTD. 2007-06-21 US disclosed