SCHEMBL5083960

SCHEMBL5083960

CC(C)(C)C1=C([Ti](Oc2cccc(-c3ccccc3)c2)=C(c2ccccc2)c2ccccc2)CC=C1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
FAAH O00519 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
EPHX1 P07099 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
Hydrochloric Acid SCHEMBL717497 0.99 MAPT (0.34) MAPTTDP1FAAHRXRARXRB
SCHEMBL27517893 0.91 FAAH (0.34) MAPTTDP1FAAHEPHX1
Hydrochloric Acid SCHEMBL715334 0.90 FAAH (0.34) MAPTTDP1FAAHEPHX1
SCHEMBL3827612 0.85
Hydrochloric Acid SCHEMBL3682983 0.84 RXRA (0.34) FAAHRXRARXRBEPHX1
Hydrochloric Acid SCHEMBL714405 0.84 RXRA (0.34) MAPTTDP1FAAHRXRARXRB
Hydrochloric Acid SCHEMBL713614 0.84
Hydrochloric Acid SCHEMBL716605 0.82 RXRA (0.33) MAPTTDP1FAAHRXRARXRB
SCHEMBL7931687 0.81 FAAH (0.33) FAAHEPHX1
SCHEMBL4078413 0.81 SMN1; SMN2 (0.32) MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1498178-B1 Transition metal complex and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-06-11 EP disclosed