SCHEMBL7764160

SCHEMBL7764160

CC1=C(C)C(C)(C)C([Ti+3])=C1C.CCN(CC)C(=O)[O-].CCN(CC)C(=O)[O-].CCN(CC)C(=O)[O-]

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 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
Acetic Acid SCHEMBL7760489 0.80 CA1 (0.35)
SCHEMBL6933930 0.73 CTSD (0.32)
Trifluoroacetic Acid SCHEMBL8089245 0.72
Fluoride Ion SCHEMBL7642596 0.71 CTSD (0.33)
SCHEMBL674788 0.69 LMNA (0.43) MEN1KMT2A
SCHEMBL8623661 0.69 LMNA (0.43) MEN1KMT2A
SCHEMBL7008575 0.69 LMNA (0.43) MEN1KMT2A
SCHEMBL7155783 0.69 LMNA (0.43) MEN1KMT2A
SCHEMBL7645015 0.69 LMNA (0.43) MEN1KMT2A
SCHEMBL150701 0.69 LMNA (0.43) MEN1KMT2A

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-1102795-A1 UNBRIDGED MONOCYCLOPENTADIENYL METAL COMPLEX CATALYST HAVING IMPROVED TOLERANCE OF MODIFIED METHYLALUMINOXANE UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2001-05-30 EP disclosed
EP-0989139-A1 Unbridged monocyclopentadienyl metal complex catalyst for olefin polymerization by reacting with particulate solids with functional groups UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-03-29 EP disclosed
WO-2000006614-A1 UNBRIDGED MONOCYCLOPENTADIENYL METAL COMPLEX CATALYST HAVING IMPROVED TOLERANCE OF MODIFIED METHYLALUMINOXANE UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-02-10 WO disclosed