SCHEMBL23344490

SCHEMBL23344490

Cc1nc2nc(Sc3ccccc3)cnc2cc1NC(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 1/20 0.65
▸ RXFP1 Q9HBX9 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ABL1 P00519 1/20 0.40
▸ SRC P12931 1/20 0.40
▸ KCNK3 O14649 3/20 0.40
▸ KCNK9 Q9NPC2 3/20 0.40
▸ NR3C1 P04150 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PTGES O14684 5/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ PTGS1 P23219 1/20 0.38

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
SCHEMBL23344464 0.83 PIK3CA (0.63) PIK3CAKCNK3NPSR1PTGS1
SCHEMBL23344471 0.79 PIK3CA (0.79) PIK3CAMEN1KMT2A
SCHEMBL23344505 0.75 PIK3CA (0.86) PIK3CAMEN1KMT2A
SCHEMBL23344439 0.73 PIK3CA (0.76) PIK3CAMEN1KMT2AL3MBTL1NPSR1
SCHEMBL23344479 0.71 PIK3CA (0.71) PIK3CAMEN1KMT2AL3MBTL1
SCHEMBL21311188 0.66 HTT (0.62) RXFP1MEN1KMT2AKCNK3KCNK9
SCHEMBL23326384 0.65 BRAF (0.54) RXFP1MEN1KMT2AKCNK3KCNK9
SCHEMBL26405724 0.64 SORT1 (0.54) MEN1KMT2AABL1SRCKCNK3
SCHEMBL23326225 0.64 PIK3CA (0.53) PIK3CAMEN1KMT2A
SCHEMBL23344477 0.63 MEN1 (0.53) PIK3CAMEN1KMT2A

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 2 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-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF NATIONAL AND KAPODISTRIAN UNIVERSITY OF ATHENS (GR) 2021-05-13 — — 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 (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 PIK3CA 1262/4885RXFP1 4490/4885MEN1 4106/4885
US-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF PDXK, DPYD, PNPO PIK3CA 1262/4885RXFP1 4490/4885MEN1 4106/4885

“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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