SCHEMBL8034604

SCHEMBL8034604

CC(C)[O-].CC(C)[O-].CC(C)[O-].Cc1cccc2c1C=CC2[Ti+3]

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 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 SCHEMBL4634124 0.89 ALDH1A1 (0.33) MEN1ALDH1A1KMT2A
Bromide SCHEMBL8034463 0.89 ALDH1A1 (0.33) MEN1ALDH1A1KMT2A
SCHEMBL8040730 0.87
SCHEMBL8024794 0.86 MEN1 (0.32) MEN1ALDH1A1KMT2A
SCHEMBL8034472 0.80 MEN1 (0.32) MEN1ALDH1A1KMT2A
SCHEMBL8034369 0.79 GABRA1 (0.32) MEN1KMT2A
SCHEMBL8024793 0.79 MEN1 (0.31) MEN1ALDH1A1KMT2A
SCHEMBL9143304 0.75 CA1 (0.32)
SCHEMBL9143293 0.71 CA1 (0.32)
Lithium SCHEMBL9145275 0.71 CA1 (0.32)

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-0796875-B1 Process for the preparation of crystalline vinylaromatic polymers with a predominant syndiotactic structure ENICHEM SPA (IT) 2000-03-29 EP disclosed
US-5721327-A Process for the preparation of crystalline vinylaromatic polymers with a predominant syndiotactic structure ENICHEM S.P.A. (IT) 1998-02-24 US disclosed
EP-0796875-A2 Process for the preparation of crystalline vinylaromatic polymers with a predominant syndiotactic structure ENICHEM S.p.A. (IT) 1997-09-24 EP disclosed