SCHEMBL4510522

SCHEMBL4510522

CSc1ccccc1Cn1c(C)cc(O)c(I)c1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
KDM4E B2RXH2 4/20 0.40
LMNA P02545 3/20 0.40
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 4/20 0.36
EDNRB P24530 1/20 0.35
CHRM2 P08172 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
BCL2 P10415 1/20 0.33
MCL1 Q07820 1/20 0.33
P2RX7 Q99572 1/20 0.33
RAB9A P51151 1/20 0.32
NOX4 Q9NPH5 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL4510899 0.85 P2RX7 (0.42) ALDH1A1KDM4ELMNAKMT2APOLB
SCHEMBL4519787 0.80 MIF (0.48) ALDH1A1KDM4ELMNAKMT2AMAPT
SCHEMBL13678559 0.78 ALDH1A1 (0.50) ALDH1A1KDM4ELMNAKMT2APOLB
SCHEMBL4519402 0.77 LMNA (0.52) ALDH1A1KDM4ELMNAKMT2APOLB
SCHEMBL4506364 0.73 MAPK14 (0.40) ALDH1A1KDM4ELMNAKMT2AEDNRB
SCHEMBL4514436 0.69 MAPK14 (0.52) ALDH1A1KDM4ELMNAKMT2APOLB
SCHEMBL4517123 0.67 MAPK14 (0.51) ALDH1A1KDM4ELMNAKMT2APOLB
SCHEMBL4510666 0.65 MAPK14 (0.42) ALDH1A1KDM4ELMNAMAPTEDNRB
SCHEMBL13678555 0.63 NOTUM (0.53) ALDH1A1KDM4ELMNAKMT2APOLB
SCHEMBL2048982 0.63 CHRM2 (0.48) ALDH1A1KDM4ELMNAKMT2AMAPT

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
US-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 US disclosed
US-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 US disclosed
US-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 US disclosed
EP-1987022-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES Pfizer Products Inc. (US) 2008-11-05 EP disclosed
WO-2007091176-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-08-16 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-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PDXK, UMPS, CDK2 ALDH1A1 1197/4885KDM4E 1348/4885LMNA 2954/4885

“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.