SCHEMBL8713641

SCHEMBL8713641

C1=CCC([Ti+](Cc2ccccc2)C2=CC=CC2)=C1.CC[O-]

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL8714824 0.91 TP53 (0.32) TP53SMN1; SMN2SIGMAR1
Hydrochloric Acid SCHEMBL6357925 0.91 KDM4E (0.32) TP53SMN1; SMN2SIGMAR1
SCHEMBL8717796 0.76
SCHEMBL8715615 0.76
SCHEMBL27519489 0.75 TAAR1 (0.32) SIGMAR1
SCHEMBL6358361 0.70
SCHEMBL8713107 0.68
Hydrochloric Acid SCHEMBL4385585 0.68
SCHEMBL7171018 0.67
SCHEMBL8714416 0.67 TP53 (0.33) TP53

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
EP-0669346-B1 Solid catalyst components for olefin polymerization and use thereof NIPPON OIL CO LTD (JP) 1998-06-03 EP disclosed
US-5604170-A EFFECTIVE CATALYST SUPPORT SATISFYING CERTAIN REQUISITES: PARTICLE DIAMETER, SPECIFIC SURFACE AREA, PORE VOLUME, SPECIFIC GRAVITY; SUBJECTED TO ULTRASONIC DISINTEGRATION NIPPON OIL COMPANY, LIMITED (JP) 1997-02-18 US disclosed
EP-0669346-A1 Solid catalyst components for olefin polymerization and use thereof NIPPON OIL CO. LTD. (JP) 1995-08-30 EP disclosed