SCHEMBL4812121

SCHEMBL4812121

O=C(O)c1cccn(-c2cccnc2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
APP P05067 1/20 0.43
GAA P10253 1/20 0.43
HCAR3 P49019 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
MET P08581 1/20 0.42
CYP3A4 P08684 3/20 0.41
CYP2A6 P11509 2/20 0.41
HTT P42858 1/20 0.41
CYP2E1 P05181 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
USP2 O75604 1/20 0.40
ALOX12 P18054 1/20 0.40
KDM4E B2RXH2 5/20 0.40
EP300 Q09472 1/20 0.40
KAT2B Q92831 1/20 0.40
F10 P00742 1/20 0.39

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
SCHEMBL10707587 0.86 MKNK1 (0.48) METCYP3A4CYP2A6HTTCYP2E1
SCHEMBL25233228 0.84 RIPK3 (0.45) ALDH1A1METCYP3A4HTTL3MBTL1
SCHEMBL1137068 0.83 KDM4E (0.54) ALDH1A1HTTL3MBTL1TDP1POLB
SCHEMBL31456668 0.82 MET (0.46) ALDH1A1METCYP3A4CYP2A6HTT
SCHEMBL4817184 0.82 MAPK1 (0.51) ALDH1A1GAAMETKDM4ETSHR
SCHEMBL31456688 0.80 MET (0.38) GAAMETCYP3A4CYP2A6HTT
SCHEMBL20688877 0.80 HCAR2 (0.41) HCAR2METL3MBTL1TDP1POLB
SCHEMBL31456637 0.79 NPC1 (0.54) ALDH1A1GAAKDM4EMAPTTSHR
SCHEMBL31456679 0.79 CYP3A4 (0.45) ALDH1A1GAACYP3A4CYP2A6HTT
SCHEMBL31456729 0.79 CYP2A6 (0.53) ALDH1A1GAACYP3A4CYP2A6HTT

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119998271-A Pyridone compound and preparation method and application thereof 深圳信立泰药业股份有限公司 2025-05-13 CN disclosed
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US disclosed
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US disclosed
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US disclosed
CN-101005843-A Pyrrolotriazine kinase inhibitors BRISTOL MYERS SQUIBB CO (US) 2007-07-25 CN disclosed
US-7173031-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 US disclosed
US-7173031-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 US disclosed
US-7173031-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 US disclosed
US-20060211695-A1 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2006-09-21 US disclosed
US-20060004006-A1 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2006-01-05 US disclosed
US-20050288290-A1 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-12-29 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 (3 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-20050288290-A1 Fused heterocyclic kinase inhibitors MAP3K20, MAP3K19, ABL1 ALDH1A1 3087/4885APP 4097/4885GAA 1488/4885
US-20060004006-A1 Pyrrolotriazine kinase inhibitors MAP3K5, MAP3K15, MAP4K2 ALDH1A1 3818/4885APP 2636/4885GAA 2824/4885
US-20060211695-A1 Fused heterocyclic kinase inhibitors MAP3K20, MAP3K19, ABL1 ALDH1A1 3087/4885APP 4097/4885GAA 1488/4885

“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.