SCHEMBL1206385

SCHEMBL1206385

CC(C)N(C)C(=O)C(O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.47
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
GAA P10253 1/20 0.46
MTOR P42345 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SRC P12931 2/20 0.43
AOC3 Q16853 1/20 0.43
ALOX5 P09917 1/20 0.42

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
SCHEMBL1206380 1.00 LMNA (0.52) LMNAMAPK1KDM4EALDH1A1HPGD
SCHEMBL6739918 0.77 HDAC1 (0.45) LMNAMAPK1KDM4EALDH1A1GAA
SCHEMBL7384844 0.77 HDAC1 (0.45) LMNAMAPK1KDM4EALDH1A1GAA
SCHEMBL6739916 0.77 HDAC1 (0.45) LMNAMAPK1KDM4EALDH1A1GAA
SCHEMBL10329425 0.76 LMNA (0.50) LMNAMAPK1KDM4EALDH1A1HPGD
SCHEMBL29988941 0.76 LMNA (0.50) LMNAMAPK1KDM4EALDH1A1HPGD
SCHEMBL15005865 0.75 ALDH1A1 (0.48) ALDH1A1GAAMTORSRCALOX5
Mandelic Acid SCHEMBL1131369 0.74 LMNA (0.72) LMNAMAPK1KDM4EALDH1A1HPGD
SCHEMBL5847528 0.74 HTR2A (0.52) LMNAMAPK1KDM4EALDH1A1HPGD
SCHEMBL29103977 0.73 SMN1; SMN2 (0.58) LMNAMAPK1KDM4EALDH1A1HPGD

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-1979356-B1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PFIZER PROD INC (US) 2013-09-18 EP 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
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 LMNA 3611/4885MAPK1 78/4885KDM4E 1361/4885

“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.