SCHEMBL4515765

SCHEMBL4515765

Cc1c(OCc2ccccc2C#N)cc(C)n(Cc2ccccc2)c1=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.56
MAOB P27338 1/20 0.44
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 2/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
FFAR1 O14842 1/20 0.41
EGLN3 Q9H6Z9 1/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL4512896 0.91 MAPK14 (0.52) MAPK14MAOBALDH1A1KDM4ELMNA
SCHEMBL4514286 0.89 MAPK14 (0.69) MAPK14ALDH1A1KDM4ELMNA
SCHEMBL4506128 0.83 MAPK14 (0.53) MAPK14ALDH1A1KMT2A
SCHEMBL14434504 0.83 MAPK14 (0.49) MAPK14ALDH1A1
SCHEMBL4512116 0.83 MAPK14 (0.54) MAPK14MAOBALDH1A1KDM4ELMNA
SCHEMBL14434850 0.82 MAPK14 (0.49) MAPK14MAOBALDH1A1KDM4ELMNA
SCHEMBL4521334 0.81 MAOB (0.47) MAPK14MAOBALDH1A1KDM4ELMNA
SCHEMBL4511623 0.81 MAPK14 (0.64) MAPK14MAOB
SCHEMBL13678560 0.79 CASP3 (0.44) MAPK14ALDH1A1KDM4EKMT2AHPGD
SCHEMBL4511905 0.79 MAPK14 (0.45) MAPK14ALDH1A1KDM4ELMNAKMT2A

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 3 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

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 117/4885MAOB 81/4885ALDH1A1 1197/4885

“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.