SCHEMBL4444608

SCHEMBL4444608

CC(C)(C)P(Cc1ccccc1CP(C(C)(C)C)C(C)(C)C)C(C)(C)C.[Pd]

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
RIPK1 Q13546 2/20 0.31
PNMT P11086 1/20 0.31
IDO1 P14902 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TAAR1 Q96RJ0 4/20 0.30
MGLL Q99685 1/20 0.30
SLC6A2 P23975 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
SCHEMBL34189 0.97 GABRA1 (0.33) BCHEACHEGABRA1GABRB2RIPK1
SCHEMBL29381329 0.97 GABRA1 (0.33) BCHEACHEGABRA1GABRB2RIPK1
SCHEMBL4449614 0.93 RIPK1 (0.34) BCHEACHEGABRA1GABRB2RIPK1
SCHEMBL30872867 0.89 PNMT (0.32) PNMTIDO1ALDH1A1MEN1KMT2A
SCHEMBL17750351 0.89 GABRA1 (0.43) GABRA1GABRB2ALDH1A1MEN1KMT2A
SCHEMBL20732795 0.85 RIPK1 (0.33) RIPK1
SCHEMBL3680536 0.84 TAAR1 (0.43) ACHEALDH1A1MEN1KMT2ATAAR1
SCHEMBL1948544 0.83 RIPK1 (0.32) RIPK1SLC6A2
SCHEMBL1423269 0.83 CYP3A4 (0.31) RIPK1
SCHEMBL5598297 0.82 TAAR1 (0.42) RIPK1IDO1ALDH1A1MEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1554039-B1 A CATALYST SYSTEM COMPRISING A 1,2-BIS-(PHOSPHINO)METALLOCENE LIGAND LUCITE INT UK LTD (GB) 2013-07-03 EP disclosed
US-7485739-B2 Catalyst system LUCITE INTERNATIONAL UK LTD. (GB) 2009-02-03 US disclosed
US-20060252935-A1 Catalyst system LUCITE INTERNATIONAL UK LIMITED (GB) 2006-11-09 US disclosed
EP-1554039-A2 A CATALYST SYSTEM COMPRISING A 1,2-BIS-(PHOSPHINOALKYL)FERROCENE LIGAND Lucite International UK Limited (GB) 2005-07-20 EP disclosed
WO-2004024322-A2 A CATALYST SYSTEM COMPRISING A 1,2-BIS-(PHOSPHINOALKYL) FERROCENE LIGAND LUCITE INTERNATIONAL UK LIMITED (GB) 2004-03-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060252935-A1 Catalyst system ELOB, SOD1, ESR1 BCHE 952/4885ACHE 991/4885GABRA1 3940/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.