SCHEMBL1205147

SCHEMBL1205147

CN(C)C[C@@H](O)C1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.52
KDM4E B2RXH2 2/20 0.50
GMNN O75496 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
SHBG P04278 1/20 0.39
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
EPHX1 P07099 1/20 0.34

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
SCHEMBL27747569 1.00 TP53 (0.52) TP53KDM4EGMNNLMNAMAPT
SCHEMBL24715426 1.00 TP53 (0.52) TP53KDM4EGMNNLMNAMAPT
SCHEMBL28846887 0.88
SCHEMBL22624869 0.80 TP53 (0.50) TP53KDM4EGMNNLMNAMAPT
SCHEMBL12631952 0.78 SLC6A2 (0.48) TP53KDM4EGMNNLMNAMAPT
SCHEMBL12631967 0.78 SLC6A2 (0.48) TP53KDM4EGMNNLMNAMAPT
SCHEMBL4000568 0.78 CPN1 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL20095863 0.77 KMT2A (0.43) TP53KDM4EGMNNLMNAMAPT
SCHEMBL20096006 0.77 KMT2A (0.43) TP53KDM4EGMNNLMNAMAPT
SCHEMBL20095865 0.77 KMT2A (0.43) TP53KDM4EGMNNLMNAMAPT

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
EP-1979356-B1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PFIZER PROD INC (US) 2013-09-18 EP disclosed
CN-101346382-B Carbonylamino pyrrolopyrazoles, potent kinase inhibitors PFIZER PROD INC 2011-07-06 CN disclosed
US-7884117-B2 Protein kinase inhibitors such as (S)-2-(methylamino)-1-phenylethyl 3-(4-fluorobenzamido)-6,6-dimethylpyrrolo[3,4-c]pyrazole-5(1H,4H,6H)-carboxylate, used for the treatment of abnormal cell growth in mammals; antiproliferative agents PFIZER INC. (US) 2011-02-08 US disclosed
US-20090318440-A1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PFIZER INC. 2009-12-24 US disclosed
CN-101346382-A Carbonylamino pyrrolopyrazoles, potent kinase inhibitors PFIZER PROD INC (US) 2009-01-14 CN disclosed
EP-1979356-A2 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS Pfizer Products Inc. (US) 2008-10-15 EP disclosed
WO-2007072153-A2 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2007-06-28 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-20090318440-A1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PAK4, PAK5, PAK3 TP53 1444/4885KDM4E 1361/4885GMNN 2234/4885

“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.