SCHEMBL6709694

SCHEMBL6709694

C[Si](C)(C)n1ccnc1.NCCCn1ccnc1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 7/20 0.53
PRKCI P41743 1/20 0.45
QPCT Q16769 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL5668743 0.89 TBXAS1 (0.42) TBXAS1PRKCIQPCT
SCHEMBL78110 0.86
SCHEMBL9253280 0.86 TBXAS1 (0.71) TBXAS1PRKCI
Bromide SCHEMBL28608395 0.84 TBXAS1 (0.68) TBXAS1PRKCI
Hydrochloric Acid SCHEMBL2674176 0.84 TBXAS1 (0.68) TBXAS1PRKCIMEN1KMT2AATM
Fluoride SCHEMBL31379738 0.84 TBXAS1 (0.68) TBXAS1PRKCI
Water SCHEMBL2854772 0.84 TBXAS1 (0.68) TBXAS1PRKCI
Hydrochloric Acid SCHEMBL4781930 0.84 TBXAS1 (0.68) TBXAS1PRKCIMEN1KMT2AATM
Iodide SCHEMBL29834228 0.84 TBXAS1 (0.68) TBXAS1PRKCI
1-Methylimidazole SCHEMBL29053358 0.81 TBXAS1 (0.59) TBXAS1PRKCIQPCTMEN1KMT2A

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-1248615-A4 THIAZOLE, IMIDAZOLE AND OXAZOLE COMPOUNDS AND TREATMENTS OF DISORDERS ASSOCIATED WITH PROTEIN AGING ALTEON INC (US) 2004-08-04 EP disclosed
EP-1248615-A1 THIAZOLE, IMIDAZOLE AND OXAZOLE COMPOUNDS AND TREATMENTS OF DISORDERS ASSOCIATED WITH PROTEIN AGING Alteon, Inc. (US) 2002-10-16 EP disclosed
WO-2001052847-A1 THIAZOLE, IMIDAZOLE AND OXAZOLE COMPOUNDS AND TREATMENTS OF DISORDERS ASSOCIATED WITH PROTEIN AGING ALTEON, INC. (US) 2001-07-26 WO disclosed