SCHEMBL4344827

SCHEMBL4344827

Cc1ccc(Nc2ccn3ncc(-c4cccc(OC(F)(F)F)c4)c3n2)cc1NS(C)(=O)=O

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FYN P06241 4/20 0.73
PIM1 P11309 12/20 0.53
PIM2 Q9P1W9 9/20 0.53
FLT3 P36888 1/20 0.53
KCNH2 Q12809 1/20 0.52
TGFBR2 P37173 1/20 0.47
PIK3CG P48736 1/20 0.43
BACE1 P56817 1/20 0.42
RET P07949 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
SCHEMBL103286 0.91 FYN (0.67) FYNPIM1PIM2FLT3KCNH2
SCHEMBL4333715 0.90 FYN (0.78) FYNPIM1PIM2TGFBR2PIK3CG
SCHEMBL4334702 0.88 FYN (0.77) FYNPIM1PIM2FLT3PIK3CG
SCHEMBL4326932 0.87 FYN (0.81) FYNPIM1PIM2TGFBR2PIK3CG
SCHEMBL4340636 0.86 FYN (0.83) FYNPIM1PIM2TGFBR2PIK3CG
SCHEMBL14302401 0.86 FYN (0.83) FYNPIM1PIM2TGFBR2PIK3CG
SCHEMBL4338286 0.85 FYN (0.81) FYNPIM1PIM2TGFBR2PIK3CG
SCHEMBL14301998 0.85 FYN (0.81) FYNPIM1PIM2TGFBR2PIK3CG
SCHEMBL4347134 0.85 FYN (1.00) FYNPIM1PIM2TGFBR2PIK3CG
SCHEMBL4337292 0.85 FYN (0.81) FYNPIM1PIM2FLT3BACE1

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
EP-2049539-A1 PYRAZOLOPYRIMIDINES AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME. Bayer Schering Pharma Aktiengesellschaft (DE) 2009-04-22 EP claimed
US-20080039455-A1 PYRAZOLOPYRIMIDINES AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME BAYER INTELLECTUAL PROPERTY GMBH (DE) 2008-02-14 US claimed
EP-1873157-A1 Pyrazolopyrimidines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same Bayer Schering Pharma Aktiengesellschaft (DE) 2008-01-02 EP claimed
WO-2007147647-A1 PYRAZOLOPYRIMIDINES AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME. BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-12-27 WO claimed
US-20080039455-A1 PYRAZOLOPYRIMIDINES AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME BAYER INTELLECTUAL PROPERTY GMBH (DE) 2008-02-14 US disclosed
EP-1873157-A1 Pyrazolopyrimidines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same Bayer Schering Pharma Aktiengesellschaft (DE) 2008-01-02 EP 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-20080039455-A1 PYRAZOLOPYRIMIDINES AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME DPYD, FLT1, PDXK FYN 151/4885PIM1 400/4885PIM2 424/4885

“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.