SCHEMBL1925115

SCHEMBL1925115

FC(F)(F)c1cccc(-c2cc(C(F)(F)F)n3cnc(-c4cccnc4)c3n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.47
NPY5R Q15761 1/20 0.46
MC4R P32245 1/20 0.42
KCNA5 P22460 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
CLK1 P49759 1/20 0.40
DYRK1A Q13627 1/20 0.40
HTR2B P41595 1/20 0.40
HTR6 P50406 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
KMO O15229 1/20 0.40
GRIN1 Q05586 2/20 0.39
GRIN2B Q13224 2/20 0.39
SCD O00767 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
IDO1 P14902 1/20 0.39
KIF11 P52732 1/20 0.39
NPC1 O15118 1/20 0.38

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
SCHEMBL1924312 0.91 NPY5R (0.43) PIM1NPY5RSMN1; SMN2HTR2BHTR6
SCHEMBL1925218 0.89 NPC1 (0.44) KMOGRIN1GRIN2BKDM4EALDH1A1
SCHEMBL1924686 0.86 PSD (0.50) NPY5RSMN1; SMN2KDM4EALDH1A1NPC1
SCHEMBL1925499 0.84 TP53 (0.43) SMN1; SMN2KDM4EALDH1A1
SCHEMBL1924986 0.84 TP53 (0.46) SMN1; SMN2KDM4EALDH1A1
SCHEMBL1925737 0.84 PSD (0.42) SMN1; SMN2CYP11B1CYP11B2KMOGRIN1
SCHEMBL1924537 0.83 GAA (0.43) SMN1; SMN2KDM4EALDH1A1NPC1RAB9A
SCHEMBL1926736 0.83 KMO (0.41) KMOKDM4EALDH1A1
SCHEMBL1924866 0.82 NPC1 (0.38) PIM1NPY5RKCNA5SMN1; SMN2NPC1
SCHEMBL1924870 0.78 KIF11 (0.44) KDM4EALDH1A1KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1670801-B1 PYRAZOLO AND IMIDAZO-PYRIMIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-06-08 EP disclosed
US-7514443-B2 Substituted pyrazolo[1,5-a]pyrimidines as inhibitors of metabotropic glutamate receptors HOFFMANN-LA ROCHE INC. (US) 2009-04-07 US disclosed
US-20080051421-A1 Pyrazolo-pyridine WICHMANN JUERGEN 2008-02-28 US disclosed
US-7329662-B2 Pyrazolo-pyridine HOFFMANN-LA ROCHE INC. (US) 2008-02-12 US disclosed
EP-1670801-A1 PYRAZOLO AND IMIDAZO-PYRIMIDINE DERIVATIVES F. Hoffmann-Roche AG (CH) 2006-06-21 EP disclosed
US-20050130992-A1 Pyrazolo-pyridine F. HOFFMANN-LA ROCHE AG (CH) 2005-06-16 US disclosed
WO-2005040171-A1 PYRAZOLO AND IMIDAZO-PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-05-06 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 (2 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-20050130992-A1 Pyrazolo-pyridine CHRM2, CHRM1, QDPR PIM1 2356/4885NPY5R 188/4885MC4R 687/4885
US-20080051421-A1 Pyrazolo-pyridine CHRM2, CHRM1, QDPR PIM1 2356/4885NPY5R 188/4885MC4R 687/4885

“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.