SCHEMBL20595312

SCHEMBL20595312

Cc1nc2nc(Nc3ccc(C(=O)O)cc3)cnc2cc1NC(=O)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 1/20 0.52
▸ GRIK1 P39086 7/20 0.50
▸ PIK3CA P42336 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ MAPK8 P45983 1/20 0.49
▸ MAPK9 P45984 1/20 0.49
▸ MAPK10 P53779 1/20 0.49
▸ IDH1 O75874 1/20 0.49
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ PIN1 Q13526 1/20 0.48
▸ MAPT P10636 4/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ LMNA P02545 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ HTT P42858 1/20 0.45
▸ EPHX2 P34913 1/20 0.45

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
SCHEMBL23326380 0.94 PIK3CA (0.55) GRIK1PIK3CAMAPK1MAPK8MAPK9
SCHEMBL20595313 0.90 CDK8 (0.52) GRIK1PIK3CAMAPK1IDH1MEN1
SCHEMBL23326251 0.90 MEN1 (0.52) GRIK1PIK3CAMAPK1MAPK8MAPK9
SCHEMBL20595368 0.88 MEN1 (0.50) GRIK1PIK3CAMAPK1IDH1MEN1
SCHEMBL20595310 0.84 RAF1 (0.49) GRIK1PIK3CAMEN1KMT2AMAPT
SCHEMBL23326384 0.84 BRAF (0.54) AURKAMEN1KMT2AMAPTLMNA
SCHEMBL20595298 0.82 PIK3CA (0.46) PIK3CAMAPK8MAPK9MAPK10MEN1
SCHEMBL23344475 0.82 PIK3CA (0.52) PIK3CAMAPK8MAPK9MAPK10
SCHEMBL23344453 0.82 PIK3CA (0.68) PIK3CAMAPK1MAPK8MAPK9MAPK10
SCHEMBL23326325 0.81 PIK3CA (0.58) PIK3CAMAPK1MAPK8MAPK9MAPK10

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
US-11117894-B2 Pyridopyrazine compounds and uses thereof CITY OF HOPE (US) 2021-09-14 — — US disclosed
US-11117894-B2 Pyridopyrazine compounds and uses thereof CITY OF HOPE (US) 2021-09-14 — — US disclosed
US-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF NATIONAL AND KAPODISTRIAN UNIVERSITY OF ATHENS (GR) 2021-05-13 — — US disclosed
US-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF NATIONAL AND KAPODISTRIAN UNIVERSITY OF ATHENS (GR) 2021-05-13 — — US disclosed
WO-2018237190-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF CITY OF HOPE (US) 2018-12-27 — — 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-11117894-B2 Pyridopyrazine compounds and uses thereof PDXK, DPYD, PNPO AURKA 803/4885GRIK1 1709/4885PIK3CA 1262/4885
US-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF PDXK, DPYD, PNPO AURKA 803/4885GRIK1 1709/4885PIK3CA 1262/4885

“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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