SCHEMBL4958491

SCHEMBL4958491

CC(C)C(CO)NC1=NC(=O)CS1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.47
POLB P06746 1/20 0.47
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
FYN P06241 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
SCHEMBL4958498 1.00 CYP1A2 (0.47) CYP1A2POLBMEN1ALDH1A1LMNA
SCHEMBL4960465 0.70 MAPKAPK2 (0.44) CYP1A2POLB
SCHEMBL14452553 0.68 KMT2A (0.47) CYP1A2POLBMEN1LMNAKMT2A
SCHEMBL12737480 0.65 IDH1 (0.44) CYP1A2POLBLMNA
SCHEMBL4876531 0.59 CYP1A2 (0.44) CYP1A2POLB
SCHEMBL13815446 0.55 CYP1A2 (0.36) CYP1A2POLBMEN1ALDH1A1LMNA
SCHEMBL3444514 0.54
SCHEMBL12133544 0.54
SCHEMBL4716796 0.54
SCHEMBL4330718 0.54 CNR1 (0.36) MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100569773-C Novel azaindole thiazolinone as carcinostatic agent HOFFMANN LA ROCHE (CH) 2009-12-16 CN disclosed
EP-1805175-B1 NOVEL AZAINDOLE THIAZOLINONES AS ANTI-CANCER AGENTS HOFFMANN LA ROCHE (CH) 2008-03-05 EP disclosed
CN-101039943-A Novel azaindole thiazolinones as anti-cancer agents HOFFMANN LA ROCHE (CH) 2007-09-19 CN disclosed
US-7247727-B2 Azaindole thiazolinones HOFFMANN-LA ROCHE INC. (US) 2007-07-24 US disclosed
EP-1805175-A1 NOVEL AZAINDOLE THIAZOLINONES AS ANTI-CANCER AGENTS F. Hoffmann-Roche AG (CH) 2007-07-11 EP disclosed
US-20060084674-A1 Azaindole thiazolinones CHEN SHAOQING 2006-04-20 US disclosed
WO-2006040049-A1 NOVEL AZAINDOLE THIAZOLINONES AS ANTI-CANCER AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2006-04-20 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-20060084674-A1 Azaindole thiazolinones CDK1, CDK2, CDK12 CYP1A2 3707/4885POLB 1055/4885MEN1 1807/4885

“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.