SCHEMBL10216360

SCHEMBL10216360

O=C(O)c1n[nH]c2c1CCc1cnc(-c3ccc(F)cc3)nc1-2

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 8/20 0.39
CYP1A2 P05177 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
HCAR2 Q8TDS4 3/20 0.38
CYP3A4 P08684 1/20 0.36
HTT P42858 1/20 0.36
HAO2 Q9NYQ3 1/20 0.36
DHODH Q02127 1/20 0.35
CA12 O43570 1/20 0.34
ALPL P05186 1/20 0.34
RPA1 P27694 1/20 0.34

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
SCHEMBL1894800 0.77 MAP3K14 (0.41) MAPTKMT2AHCAR2HTT
SCHEMBL11938648 0.76 CCNA2 (0.57) MAPKAPK2CYP1A2MEN1LMNAMAPT
SCHEMBL12499727 0.72 MEN1 (0.49) MAPKAPK2CYP1A2MEN1LMNAMAPT
SCHEMBL9941063 0.72 CDK2 (0.46) CYP1A2MEN1LMNAMAPTCYP2C9
SCHEMBL11024059 0.70 MAPKAPK2 (0.47) MAPKAPK2MEN1MAPTKMT2A
Trifluoroacetic Acid SCHEMBL9940945 0.69 CDK2 (0.53)
SCHEMBL3515853 0.67 HAO2 (0.42) KMT2AHCAR2HAO2CA12ALPL
SCHEMBL3503647 0.67 CCNA2 (0.39)
SCHEMBL28206510 0.66 MEN1 (0.46) CYP1A2MEN1LMNAMAPTCYP2C9
SCHEMBL9940817 0.66 CDK2 (0.52)

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
US-8541576-B2 Substituted pyrazolo-quinazoline derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL (IT) 2013-09-24 US 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 MAPKAPK2 30/4885CYP1A2 3444/4885MEN1 4293/4885

“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.