SCHEMBL3204971

SCHEMBL3204971

Cl[Ti](Cl)OC(c1ccccc1)c1ccccc1C1c2ccccc2-c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 10/20 0.38
TDO2 P48775 10/20 0.38
IDO2 Q6ZQW0 2/20 0.38
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
MAPT P10636 2/20 0.35
CYP2C9 P11712 1/20 0.35
LMNA P02545 1/20 0.35
MTOR P42345 1/20 0.35
PMP22 Q01453 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.34
ATM Q13315 1/20 0.34
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
ADRA2A P08913 1/20 0.32
CHRM1 P11229 1/20 0.32

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
SCHEMBL3201538 0.78 POLB (0.33) MEN1KMT2APOLBATMADRA2A
SCHEMBL3199265 0.78 IDO1 (0.33) IDO1TDO2IDO2CYP1A2CYP3A4
SCHEMBL3212272 0.77 NCOA3 (0.33)
SCHEMBL3201571 0.74 MAPT (0.32) IDO1TDO2IDO2CYP1A2CYP3A4
SCHEMBL3684777 0.69 PNMT (0.37) IDO1TDO2IDO2CYP2D6CHRM2
Hydrochloric Acid SCHEMBL3210625 0.66 MEN1 (0.36) IDO1TDO2IDO2MEN1KMT2A
SCHEMBL28856362 0.65 GABRA1 (0.41) CYP1A2CYP3A4LMNAMEN1KMT2A
SCHEMBL3259812 0.65 MEN1 (0.33) MEN1KMT2APOLBATM
SCHEMBL3260464 0.63 GPR3 (0.36) LMNAMEN1KMT2APOLBATM
SCHEMBL3198546 0.61 HTR2A (0.37) IDO1MEN1KMT2APOLBATM

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-7671226-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-02 US disclosed
EP-1426379-B1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME SUMITOMO CHEMICAL CO (JP) 2009-11-11 EP disclosed