SCHEMBL3860945

SCHEMBL3860945

CCCCN([Ti])C(C)c1ccccc1C1=C(C)C=CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.34
LMNA P02545 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
Hydrochloric Acid SCHEMBL3263037 0.84 PKM (0.36) PKM
SCHEMBL4047480 0.76
Hydrochloric Acid SCHEMBL3260085 0.73
SCHEMBL3860946 0.72 APAF1 (0.34)
Hydrochloric Acid SCHEMBL3263040 0.71 APAF1 (0.33)
SCHEMBL3213783 0.70 PARP1 (0.31)
Hydrochloric Acid SCHEMBL3258025 0.70
Hydrochloric Acid SCHEMBL3257792 0.70
Hydrochloric Acid SCHEMBL3261783 0.70 PKM (0.34) PKM
Hydrochloric Acid SCHEMBL3201951 0.69 ESR1 (0.30)

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-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