SCHEMBL4476474

SCHEMBL4476474

Cc1cc(N)ccc1OC1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.53
CHEK2 O96017 1/20 0.49
NR1H2 P55055 1/20 0.46
PIK3CD O00329 5/20 0.43
PIK3CA P42336 2/20 0.43
PIK3CB P42338 2/20 0.43
PIK3CG P48736 2/20 0.43
USP30 Q70CQ3 2/20 0.43
PRMT5 O14744 1/20 0.42
WDR77 Q9BQA1 1/20 0.42
PDE4A P27815 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 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
SCHEMBL30912511 0.93 PDE4B (0.52) PDE4BNR1H2PIK3CDPIK3CAPIK3CB
SCHEMBL30912524 0.93 PDE4B (0.52) PDE4BNR1H2PIK3CDPIK3CAPIK3CB
SCHEMBL13419722 0.88 PDE4B (0.52) PDE4BCHEK2NR1H2PIK3CDPIK3CA
SCHEMBL4460693 0.86 PDE4B (0.54) PDE4BCHEK2NR1H2PDE4APDE4C
SCHEMBL4358976 0.84 CHEK2 (0.59) PDE4BCHEK2NR1H2PIK3CDUSP30
SCHEMBL31663781 0.83 PIK3CD (0.47) PDE4BCHEK2PIK3CDPIK3CAPIK3CB
SCHEMBL4476418 0.83 PDE4B (0.49) PDE4BCHEK2PIK3CDPIK3CAPIK3CB
SCHEMBL28826952 0.82 CHEK2 (0.55) PDE4BCHEK2NR1H2USP30PRMT5
SCHEMBL4202110 0.81 PDE4B (0.59) PDE4BNR1H2PIK3CDPIK3CAPIK3CB
SCHEMBL4202107 0.81 PDE4B (0.59) PDE4BNR1H2PIK3CDPIK3CAPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7585869-B2 Substituted heterocylces for the treatment of abnormal cell growth PFIZER, INC. (US) 2009-09-08 US disclosed
US-7585869-B2 Substituted heterocylces for the treatment of abnormal cell growth PFIZER, INC. (US) 2009-09-08 US disclosed
US-7585869-B2 Substituted heterocylces for the treatment of abnormal cell growth PFIZER, INC. (US) 2009-09-08 US disclosed
EP-1636195-A1 QUINAZOLINES AND PYRIDO[3,4-D]PYRIMIDINES AS RECEPTOR TYROSINE KINASE INHIBITORS Pfizer Products Inc. (US) 2006-03-22 EP disclosed
WO-2004106308-A1 QUINAZOLINES AND PYRIDO [3,4-D] PYRIMIDINES AS RECEPTOR TYROSINE KINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2004-12-09 WO disclosed
US-20040242604-A1 Substituted heterocycles for the treatment of abnormal cell growth PFIZER INC 2004-12-02 US 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-20040242604-A1 Substituted heterocycles for the treatment of abnormal cell growth CCNA1, CCNT1, CCNY PDE4B 1462/4885CHEK2 1963/4885NR1H2 913/4885

“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.