SCHEMBL20565589

SCHEMBL20565589

C#Cc1ccc2[nH]c3c(C#N)c(C4CCC(c5ccc(Cl)cc5)CC4)nn3c(=O)c2c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ARF6 P62330 2/20 0.36
▸ GRM2 Q14416 1/20 0.35
▸ PARP1 P09874 1/20 0.33
▸ PARP2 Q9UGN5 1/20 0.33
▸ PSD A5PKW4 1/20 0.32
▸ FASN P49327 7/20 0.32
▸ TLR9 Q9NR96 1/20 0.32
▸ TLR8 Q9NR97 1/20 0.32
▸ TLR7 Q9NYK1 1/20 0.32
▸ PLAT P00750 2/20 0.32
▸ SLC2A1 P11166 1/20 0.31
▸ BIRC5 O15392 2/20 0.31
▸ CCNC P24863 1/20 0.31
▸ CDK8 P49336 1/20 0.31
▸ MIF P14174 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
SCHEMBL20565526 0.90 GRM2 (0.38) ARF6GRM2TLR9TLR8TLR7
SCHEMBL20565130 0.90 GRM2 (0.38) ARF6GRM2TLR9TLR8TLR7
SCHEMBL22000870 0.88 PLAT (0.43) ARF6TLR9TLR8TLR7PLAT
SCHEMBL20565522 0.87 PLAT (0.36) ARF6GRM2TLR9TLR8TLR7
Hydrochloric Acid SCHEMBL20564456 0.87 PLAT (0.42) ARF6TLR9TLR8TLR7PLAT
SCHEMBL20564892 0.84 GRM2 (0.38) GRM2PARP1PSDSLC2A1
SCHEMBL20564871 0.84 ARF6 (0.34) ARF6PARP1FASNPLAT
SCHEMBL20565527 0.84 ARF6 (0.38) ARF6GRM2PLATBIRC5MIF
SCHEMBL20564868 0.80 GPR119 (0.41) TLR8TLR7
SCHEMBL20564852 0.78 LMNA (0.42) GRM2

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-11192893-B2 Pyrazoloquinazolinone antitumor agents THE ROCKEFELLER UNIVERSITY (US) 2021-12-07 — — US disclosed
US-11192893-B2 Pyrazoloquinazolinone antitumor agents THE ROCKEFELLER UNIVERSITY (US) 2021-12-07 — — US disclosed
US-20200148687-A1 PYRAZOLOQUINAZOLINONE ANTITUMOR AGENTS THE ROCKEFELLER UNIVERSITY (US) 2020-05-14 — — US disclosed
US-20200148687-A1 PYRAZOLOQUINAZOLINONE ANTITUMOR AGENTS THE ROCKEFELLER UNIVERSITY (US) 2020-05-14 — — US disclosed
EP-3624805-A1 PYRAZOLOQUINAZOLINONE ANTITUMOR AGENTS Kapoor, Tarun, M. (US) 2020-03-25 — — EP disclosed
WO-2018213712-A1 PYRAZOLOQUINAZOLINONE ANTITUMOR AGENTS KAPOOR TARUN M (US) 2018-11-22 — — 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 (2 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-20200148687-A1 PYRAZOLOQUINAZOLINONE ANTITUMOR AGENTS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCCS, TPD52L2 ARF6 997/4885GRM2 4780/4885PARP1 303/4885
US-11192893-B2 Pyrazoloquinazolinone antitumor agents H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCCS, TPD52L2 ARF6 997/4885GRM2 4780/4885PARP1 303/4885

“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.

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