SCHEMBL17889331

SCHEMBL17889331

COc1ccc(NC(=O)N2CCN(c3nc(N)nc4[nH]ncc34)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 4/20 0.61
KCNH2 Q12809 3/20 0.61
PDGFRB P09619 3/20 0.60
PAK1 Q13153 2/20 0.58
CYP3A4 P08684 1/20 0.56
MAPT P10636 2/20 0.55
KIT P10721 3/20 0.52
CA12 O43570 2/20 0.52
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
CA9 Q16790 2/20 0.52
PTPN7 P35236 1/20 0.52
CDK1 P06493 2/20 0.51
IGF1R P08069 2/20 0.51
FGFR1 P11362 2/20 0.51
BRAF P15056 2/20 0.51
FGFR2 P21802 2/20 0.51
FGFR4 P22455 2/20 0.51
FGFR3 P22607 2/20 0.51
JAK1 P23458 2/20 0.51

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
SCHEMBL17889339 0.86 PI4KB (0.64) PI4KBKCNH2PDGFRBPAK1
SCHEMBL17889332 0.85 PI4KB (0.64) PI4KBKCNH2PDGFRBPAK1MAPT
SCHEMBL17889336 0.85 PI4KB (0.64) PI4KBKCNH2PDGFRBPAK1MAPT
SCHEMBL17377814 0.80 PI4KB (0.72) PI4KBKCNH2PDGFRBCYP3A4MAPT
SCHEMBL2278769 0.75 PDGFRB (1.00) PDGFRBKITFGFR1FGFR2FGFR4
SCHEMBL16163384 0.75 PI4KB (0.69) PI4KBKCNH2CYP3A4MAPTSMN1; SMN2
SCHEMBL18816370 0.74 PI4KB (0.63) PI4KBKCNH2PDGFRBCYP3A4MAPT
SCHEMBL18816374 0.74 PI4KB (0.63) PI4KBKCNH2PDGFRBCYP3A4MAPT
SCHEMBL18816343 0.74 PI4KB (0.63) PI4KBKCNH2PDGFRBCYP3A4MAPT
SCHEMBL28869329 0.74 MAPT (1.00) MAPTCA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE48622-E1 Therapeutically active pyrazolo-pyrimidine derivatives UCB Biopharma SRL (BE) 2021-07-06 US claimed
US-9714248-B2 Therapeutically active pyrazolo-pyrimidine derivatives UCB PHARMA SA (BE) 2017-07-25 US claimed
US-20160194329-A1 Therapeutically Active Pyrazolo-Pyrimidine Derivatives UCB PHARMA SA (BE) 2016-07-07 US claimed
US-RE48622-E1 Therapeutically active pyrazolo-pyrimidine derivatives UCB Biopharma SRL (BE) 2021-07-06 US disclosed
US-9714248-B2 Therapeutically active pyrazolo-pyrimidine derivatives UCB PHARMA SA (BE) 2017-07-25 US disclosed
US-20160194329-A1 Therapeutically Active Pyrazolo-Pyrimidine Derivatives UCB PHARMA SA (BE) 2016-07-07 US 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-20160194329-A1 Therapeutically Active Pyrazolo-Pyrimidine Derivatives HAVCR2, TPMT, NFATC1 PI4KB 275/4885KCNH2 3599/4885PDGFRB 350/4885

“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.