SCHEMBL3504873

SCHEMBL3504873

CCn1nc(C(N)=O)c2c1-c1nc(Nc3cc(N4CCN(C)CC4)ccc3OC(F)(F)F)ncc1CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 20/20 1.00
▸ PLK3 Q9H4B4 9/20 0.88
▸ PLK2 Q9NYY3 6/20 0.88
▸ FLT3 P36888 5/20 0.88
▸ CSNK2A2 P19784 1/20 0.88
▸ CSNK2B P67870 1/20 0.88
▸ CSNK2A1 P68400 1/20 0.88
▸ MELK Q14680 1/20 0.88
▸ CSNK2A3 Q8NEV1 1/20 0.88
▸ CCNA2 P20248 3/20 0.87
▸ CDK2 P24941 3/20 0.87
▸ CCNA1 P78396 3/20 0.87
▸ NEK6 Q9HC98 3/20 0.85
▸ ALK Q9UM73 1/20 0.79

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
Onvansertib SCHEMBL1228019 0.94 PLK1 (1.00) PLK1PLK3PLK2FLT3CSNK2A2
Onvansertib SCHEMBL29379736 0.94 PLK1 (1.00) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL3503742 0.94 PLK1 (1.00) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL3504256 0.93 PLK1 (1.00) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL13225440 0.92 PLK1 (1.00) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL25627189 0.92 PLK1 (0.86) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL3503253 0.92 PLK1 (1.00) PLK1PLK3PLK2FLT3CSNK2A2
Hydrochloric Acid SCHEMBL3504656 0.92 PLK1 (0.99) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL25623877 0.91 PLK1 (0.85) PLK1PLK3PLK2FLT3CSNK2A2
SCHEMBL3503601 0.90 PLK1 (1.00) PLK1PLK3PLK2FLT3CSNK2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125822-B1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2014-11-19 — — EP claimed
US-8614220-B2 Substituted pyrazolo-quinazoline derivatives, process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-12-24 — — US claimed
US-20100216808-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L (IT) 2010-08-26 — — US claimed
EP-2125822-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2009-12-02 — — EP claimed
WO-2008074788-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-26 — — WO claimed
EP-2125822-B1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2014-11-19 — — EP disclosed
US-8614220-B2 Substituted pyrazolo-quinazoline derivatives, process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-12-24 — — US disclosed
US-20100216808-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L (IT) 2010-08-26 — — US disclosed
EP-2125822-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2009-12-02 — — EP disclosed
WO-2008074788-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-26 — — 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-20100216808-A1 SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS MAP3K5, MAP3K9, MAP4K2 PLK1 91/4885PLK3 121/4885PLK2 30/4885

“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.

Send feedback