SCHEMBL7644482

SCHEMBL7644482

Cl[Ti](Cl)(=Nc1ccccc1)(C1C=Cc2ccccc21)C1C=Cc2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.32
HTR2A P28223 1/20 0.32
SIGMAR1 Q99720 2/20 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
SCHEMBL3385102 0.75 HTR6 (0.33) HTR6HTR2ASIGMAR1
SCHEMBL3381692 0.74 BRD4 (0.36) HTR6HTR2ASIGMAR1
SCHEMBL2538857 0.74 HTR2A (0.35) HTR6HTR2A
SCHEMBL7769223 0.74 HTR2A (0.35) HTR6HTR2A
SCHEMBL4457209 0.71 BRD4 (0.34) HTR6HTR2ASIGMAR1
SCHEMBL6469715 0.71 HTR6 (0.31) HTR6HTR2A
SCHEMBL4469074 0.71 HTR6 (0.31) HTR6HTR2A
SCHEMBL6906424 0.71 ATM (0.33) HTR6HTR2ASIGMAR1
SCHEMBL4470955 0.71 HTR2A (0.34) HTR6HTR2A
SCHEMBL4461067 0.71 HTR6 (0.31) HTR6HTR2A

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
US-6395846-B1 COORDINATION CATALYST COMPRISING CLAY, ORGANOSILANE COMPOUND, WATER, AND TRANSITION METAL COMPLEX; QUALITY IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2002-05-28 US disclosed
US-6255244-B1 OBTAINED BY CONTACTING A TRANSITION METAL COMPOUND, AN OXYGEN-CONTAINING COMPOUND TO FORM AN IONIC COMPLEX, AND AN ADSORBING SUBSTANCE DURING OR AFTER THE CONTACTING TREATMENT, THEN FOLLOWED BY REMOVING THE ADSORBING SUBSTANCE. IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-07-03 US disclosed
EP-1026176-A1 CATALYST FOR OLEFIN POLYMER PRODUCTION, PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING OLEFIN POLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2000-08-09 EP disclosed