SCHEMBL29721863

SCHEMBL29721863

O=C(O)c1cc2c(C(F)(F)F)ccnc2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 1/20 0.41
▸ IDO1 P14902 2/20 0.39
▸ TDO2 P48775 2/20 0.39
▸ NUDT1 P36639 4/20 0.39
▸ CCNK O75909 3/20 0.38
▸ CDK12 Q9NYV4 3/20 0.38
▸ RHEB Q15382 1/20 0.38
▸ SORT1 Q99523 1/20 0.38
▸ KMO O15229 3/20 0.37
▸ ASPH Q12797 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ GSK3A P49840 1/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ FBP1 P09467 1/20 0.36
▸ BRAF P15056 1/20 0.36

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
SCHEMBL23147937 1.00 DAO (0.41) DAOIDO1TDO2NUDT1CCNK
SCHEMBL29721793 0.87 NUDT1 (0.51) NUDT1CCNKCDK12MAPTGSK3A
SCHEMBL29722004 0.80 IDO1 (0.49) DAOIDO1TDO2NUDT1CCNK
SCHEMBL3008612 0.80 IDO1 (0.49) DAOIDO1TDO2NUDT1CCNK
SCHEMBL7976646 0.78 DAO (0.45) DAOIDO1TDO2NUDT1CCNK
SCHEMBL23147945 0.77 NUDT1 (0.51) NUDT1
SCHEMBL23147745 0.76 NUDT1 (0.44) DAOIDO1TDO2NUDT1CCNK
SCHEMBL20839678 0.76 GRIN1 (0.46) DAOIDO1TDO2NUDT1RHEB
SCHEMBL22554070 0.76 DAO (0.44) DAOIDO1TDO2NUDT1CCNK
SCHEMBL30731002 0.76 DAO (0.44) DAOIDO1TDO2NUDT1CCNK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002372-A1 AZAINDOLE CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT INC (US) 2023-01-05 — — US disclosed
EP-4034108-A1 AZAINDOLE CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS The Global Alliance for TB Drug Development, Inc. (US) 2022-08-03 — — EP disclosed
CN-114746090-A Azaindole carboxamide compounds for the treatment of mycobacterial infections 结核病药物开发全球联盟公司 2022-07-12 — — CN 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 (1 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-20230002372-A1 AZAINDOLE CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS AZI2, AADAC, TPMT DAO 778/4885IDO1 16/4885TDO2 378/4885

“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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