SCHEMBL23344475

SCHEMBL23344475

Cc1nc2nc(Nc3ccccc3)cnc2cc1NC(=O)Nc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 2/20 0.52
▸ CDK8 P49336 2/20 0.44
▸ AR P10275 1/20 0.44
▸ GRM4 Q14833 1/20 0.43
▸ KDR P35968 8/20 0.42
▸ BRAF P15056 5/20 0.42
▸ IKBKB O14920 1/20 0.42
▸ CCR2 P41597 1/20 0.42
▸ CCR5 P51681 1/20 0.42
▸ IDH2 P48735 2/20 0.41
▸ MAPK8 P45983 1/20 0.41
▸ MAPK9 P45984 1/20 0.41
▸ MAPK10 P53779 1/20 0.41
▸ RIPK1 Q13546 1/20 0.40
▸ CSF1R P07333 1/20 0.40
▸ RET P07949 1/20 0.40
▸ FGFR1 P11362 1/20 0.40
▸ FLT1 P17948 1/20 0.40
▸ FLT4 P35916 1/20 0.40
▸ FLT3 P36888 1/20 0.40

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
SCHEMBL23326235 0.87 PIK3CA (0.54) PIK3CACDK8KDRMAPK8MAPK9
SCHEMBL23326380 0.86 PIK3CA (0.55) PIK3CAKDRBRAFIDH2MAPK8
SCHEMBL23344453 0.86 PIK3CA (0.68) PIK3CAMAPK8MAPK9MAPK10
SCHEMBL20595312 0.82 AURKA (0.52) PIK3CAMAPK8MAPK9MAPK10
SCHEMBL23326232 0.82 PIK3CA (0.64) PIK3CAMAPK8MAPK9MAPK10
SCHEMBL20595313 0.81 CDK8 (0.52) PIK3CACDK8KDRBRAF
SCHEMBL20595298 0.80 PIK3CA (0.46) PIK3CAKDRMAPK8MAPK9MAPK10
SCHEMBL23326325 0.80 PIK3CA (0.58) PIK3CAMAPK8MAPK9MAPK10FLT3
SCHEMBL20595308 0.79 MEN1 (0.48) PIK3CAKDRMAPK8MAPK9MAPK10
SCHEMBL20595309 0.79 MEN1 (0.49) PIK3CACDK8BRAFMAPK8MAPK9

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 1262/4885CDK8 783/4885AR 4395/4885
US-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF PDXK, DPYD, PNPO PIK3CA 1262/4885CDK8 783/4885AR 4395/4885

“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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