SCHEMBL18752168

SCHEMBL18752168

CSc1ncc2ccc3c(C(N)=O)n(CCNC(O)OC(C)(C)C)nc3c2n1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 7/20 0.44
TTK P33981 7/20 0.44
PIM2 Q9P1W9 7/20 0.44

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
SCHEMBL10218689 0.84 PIM1 (0.45) PIM1TTKPIM2
SCHEMBL11023707 0.82 PIM1 (0.52) PIM1TTKPIM2
SCHEMBL9937049 0.81 PIM1 (0.52) PIM1TTKPIM2
Hydrochloric Acid SCHEMBL9937475 0.80 PIM1 (0.51) PIM1TTKPIM2
SCHEMBL9937233 0.78 PIM1 (0.48) PIM1TTKPIM2
SCHEMBL9937579 0.77 PIM1 (0.49) PIM1TTKPIM2
SCHEMBL10218688 0.73 PIM1 (0.40) PIM1TTKPIM2
SCHEMBL9937660 0.70 PIM1 (0.60) PIM1TTKPIM2
Hydrochloric Acid SCHEMBL9936599 0.70 PIM1 (0.59) PIM1TTKPIM2
SCHEMBL10218687 0.70 PIM1 (0.49) PIM1TTKPIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2614065-B1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2017-04-19 EP disclosed