SCHEMBL4947103

SCHEMBL4947103

CC(C)=[Ti](Cc1ccccc1)(Cc1ccccc1)(C1=CC=CC1)C1=CC=CC1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
ALPL P05186 1/20 0.30
POLB P06746 1/20 0.30
ALPG P10696 1/20 0.30
NOS2 P35228 1/20 0.30
ALPI P09923 1/20 0.30
PKM P14618 1/20 0.30
PTGS1 P23219 1/20 0.30
XIAP P98170 1/20 0.30
SLC7A5 Q01650 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
Bromide SCHEMBL8382878 0.80
Hydrochloric Acid SCHEMBL8380564 0.80
SCHEMBL4577002 0.77 ALPL (0.33) ALDH1A1ALPLPOLBALPG
SCHEMBL7754829 0.76 TP53 (0.31)
SCHEMBL27313105 0.73
SCHEMBL5179552 0.70
SCHEMBL8093934 0.70
SCHEMBL9573678 0.67
SCHEMBL7930554 0.66 MAPT (0.32)
Hydrochloric Acid SCHEMBL10325414 0.65

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
EP-1880986-A1 PROCESS FOR PRODUCING SATURATED ALIPHATIC HYDROCARBON COMPOUND, AND LUBRICANT COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2008-01-23 EP disclosed
US-20030211933-A1 Aluminum compound, method for producing the same, catalyst for producing olefinic polymers and method for producing olefinic polymers IDEMITSU KOSAN CO., LTD. (JP) 2003-11-13 US disclosed