SCHEMBL4794397

SCHEMBL4794397

COCCNC(=O)c1cnn2c(C)c(Cc3ccccc3Cl)c(C)nc12

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 10/20 0.72
LMNA P02545 10/20 0.72
MAPT P10636 4/20 0.72
KDM4E B2RXH2 6/20 0.60
ALDH1A1 P00352 6/20 0.60
HPGD P15428 5/20 0.56
HSD17B10 Q99714 3/20 0.56
NPSR1 Q6W5P4 3/20 0.56
TSHR P16473 2/20 0.56
POLB P06746 1/20 0.56
MAPK1 P28482 1/20 0.56
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
HTT P42858 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
RUVBL1 Q9Y265 1/20 0.53

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
SCHEMBL4794949 0.94 TP53 (0.67) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4777368 0.90 TP53 (0.68) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4725759 0.89 TP53 (0.60) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4797360 0.89 KDM4E (0.71) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4795070 0.87 ALDH1A1 (0.77) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4796625 0.85 LMNA (0.76) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4781908 0.85 LMNA (0.66) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4796367 0.84 KDM4E (0.63) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4781087 0.83 TP53 (0.62) TP53LMNAMAPTKDM4EALDH1A1
SCHEMBL4793265 0.83 KDM4E (0.56) TP53LMNAMAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221129-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-09-11 US claimed
WO-2008003753-A1 PYRAZOLO [1,5-A] PYRIMIDINE ANALOGS FOR USE AS INHIBITORS OF STEAROYL-COA DESATURASE (SCD) ACTIVITY BIOVITRUM AB (PUBL) (SE) 2008-01-10 WO claimed
US-20080221129-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-09-11 US disclosed
WO-2008003753-A1 PYRAZOLO [1,5-A] PYRIMIDINE ANALOGS FOR USE AS INHIBITORS OF STEAROYL-COA DESATURASE (SCD) ACTIVITY BIOVITRUM AB (PUBL) (SE) 2008-01-10 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-20080221129-A1 New compounds SCD, SCD5, FASN TP53 1572/4885LMNA 2075/4885MAPT 168/4885

“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.