SCHEMBL20105989

SCHEMBL20105989

CCOC(=O)c1cnn2ccc(N3CCCC3c3cc(F)cnc3OS(=O)(=O)C(F)(F)F)nc12

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 20/20 0.61
JAK2 O60674 19/20 0.61
JAK1 P23458 1/20 0.57

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
SCHEMBL20106508 1.00 NTRK1 (0.61) NTRK1JAK2JAK1
SCHEMBL30013959 1.00 NTRK1 (0.61) NTRK1JAK2JAK1
SCHEMBL2599290 0.92 NTRK1 (0.68) NTRK1JAK2JAK1
SCHEMBL2599293 0.92 NTRK1 (0.68) NTRK1JAK2JAK1
SCHEMBL20602710 0.91 NTRK1 (0.66) NTRK1JAK2JAK1
SCHEMBL21219502 0.91 NTRK1 (0.66) NTRK1JAK2JAK1
SCHEMBL18783276 0.89 NTRK1 (0.77) NTRK1JAK2JAK1
SCHEMBL17820741 0.89 NTRK1 (0.77) NTRK1JAK2JAK1
SCHEMBL30013797 0.89 NTRK1 (0.77) NTRK1JAK2JAK1
SCHEMBL20624671 0.87 NTRK1 (0.58) NTRK1JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019005796-A1 PROCESS FOR THE PREPARATION OF PYRAZOLO[1,5-a]PYRIMIDINES AND SALTS THEREOF ZHAO QIAN (US) 2019-01-03 WO disclosed
WO-2018081417-A2 PROCESS FOR THE PREPARATION OF PYRAZOLO[1,5-a]PYRIMIDINES AND SALTS THEREOF ZHAO QIAN (US) 2018-05-03 WO disclosed