SCHEMBL4510666

SCHEMBL4510666

CSc1ccccc1Cn1c(C)cc(OCc2ccccc2CN)cc1=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.42
KDM4E B2RXH2 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
EDNRB P24530 1/20 0.33
LMNA P02545 3/20 0.33
KLKB1 P03952 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CFD P00746 1/20 0.31
CHRM2 P08172 1/20 0.31

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
SCHEMBL4507813 0.85 GRM5 (0.35) KDM4EMAPTL3MBTL1
SCHEMBL13678551 0.85 SMN1; SMN2 (0.44) MAPK14KDM4ESMN1; SMN2ALDH1A1MAPT
SCHEMBL4514436 0.82 MAPK14 (0.52) MAPK14KDM4ESMN1; SMN2ALDH1A1MAPT
SCHEMBL4512362 0.81 KDM4E (0.44) MAPK14KDM4ESMN1; SMN2ALDH1A1MAPT
SCHEMBL4517123 0.81 MAPK14 (0.51) MAPK14KDM4EALDH1A1MAPTLMNA
SCHEMBL4519402 0.78 LMNA (0.52) KDM4EALDH1A1MAPTL3MBTL1EDNRB
SCHEMBL4376107 0.70 MAPK14 (0.57) MAPK14SMN1; SMN2ALDH1A1MAPTLMNA
SCHEMBL13678550 0.70 GRM5 (0.45) MAPK14KDM4ESMN1; SMN2ALDH1A1
SCHEMBL4521648 0.68 MAPK14 (0.43) MAPK14ALDH1A1MAPTL3MBTL1EDNRB
SCHEMBL4506734 0.68 MAPK14 (0.41) MAPK14KDM4EALDH1A1MAPTL3MBTL1

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-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
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 MAPK14 117/4885KDM4E 1348/4885SMN1; SMN2 4091/4885

“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.