SCHEMBL9940893

SCHEMBL9940893

CSc1ncc2ccc3c(C(N)=O)nn(CCNC(=O)O)c3c2n1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 7/20 0.56
TTK P33981 7/20 0.56
PIM2 Q9P1W9 7/20 0.56
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
THRB P10828 1/20 0.31
AKT1 P31749 1/20 0.31
AKT2 P31751 1/20 0.31
CFD P00746 3/20 0.31
NTRK1 P04629 1/20 0.30
HASPIN Q8TF76 1/20 0.30

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
SCHEMBL10220018 0.88 PIM1 (0.56) PIM1TTKPIM2MEN1KMT2A
SCHEMBL10218687 0.87 PIM1 (0.49) PIM1TTKPIM2
Hydrochloric Acid SCHEMBL9940892 0.87 PIM1 (0.55) PIM1TTKPIM2MEN1KMT2A
SCHEMBL9940630 0.87 PIM1 (0.63) PIM1TTKPIM2MEN1KMT2A
SCHEMBL9940666 0.86 PIM1 (0.47) PIM1TTKPIM2AKT1AKT2
SCHEMBL10220017 0.84 PIM1 (0.52) PIM1TTKPIM2MEN1KMT2A
SCHEMBL9941041 0.83 PIM1 (0.53) PIM1TTKPIM2MEN1KMT2A
SCHEMBL11023707 0.83 PIM1 (0.52) PIM1TTKPIM2RXFP1THRB
SCHEMBL9941058 0.81 PIM1 (0.57) PIM1TTKPIM2MEN1KMT2A
SCHEMBL9940522 0.79 PIM1 (0.67) PIM1TTKPIM2MEN1KMT2A

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 5 patents. 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
US-8541576-B2 Substituted pyrazolo-quinazoline derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL (IT) 2013-09-24 US disclosed
EP-2614065-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2013-07-17 EP disclosed
US-20120190678-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2012-07-26 US disclosed
WO-2012080990-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-06-21 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-20120190678-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS PIM1, PIM2, PIM3 PIM1 1/4885TTK 291/4885PIM2 2/4885

“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.