SCHEMBL23344480

SCHEMBL23344480

Cc1nc2nc(Oc3ccccc3)cnc2cc1NC(=O)Nc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 1/20 0.64
▸ IGF1R P08069 4/20 0.51
▸ MAPT P10636 5/20 0.50
▸ HTT P42858 3/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ POLB P06746 2/20 0.47
▸ KDR P35968 1/20 0.46
▸ TNNI3K Q59H18 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ IDO1 P14902 1/20 0.43
▸ F2 P00734 1/20 0.42
▸ F10 P00742 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ ALOX5 P09917 1/20 0.41

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
SCHEMBL23344453 0.81 PIK3CA (0.68) PIK3CAMAPTSMN1; SMN2POLBNPC1
SCHEMBL23344489 0.79 PIK3CA (0.65) PIK3CAIGF1RMAPTHTTSMN1; SMN2
SCHEMBL23326232 0.74 PIK3CA (0.64) PIK3CAMAPTSMN1; SMN2POLBCYP1A2
SCHEMBL23326325 0.74 PIK3CA (0.58) PIK3CAMAPTSMN1; SMN2POLBALDH1A1
SCHEMBL23344446 0.74 HTT (0.53) MAPTHTTSMN1; SMN2ALDH1A1LMNA
SCHEMBL23344505 0.72 PIK3CA (0.86) PIK3CAMAPTHTTSMN1; SMN2POLB
SCHEMBL23344470 0.71 HTT (0.50) MAPTHTTALDH1A1LMNACYP1A2
SCHEMBL23326267 0.70 PIK3CA (0.56) PIK3CAMAPTHTTSMN1; SMN2POLB
SCHEMBL23326225 0.69 PIK3CA (0.53) PIK3CAMAPTSMN1; SMN2KDRALDH1A1
SCHEMBL5447979 0.68 PIK3CA (0.61) PIK3CA

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 1262/4885IGF1R 4582/4885MAPT 2937/4885
US-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF PDXK, DPYD, PNPO PIK3CA 1262/4885IGF1R 4582/4885MAPT 2937/4885

“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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