SCHEMBL23147244

SCHEMBL23147244

O=C(NC1CCC2(CC1)CC2)c1cc2c(F)ccnc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 8/20 0.53
▸ SETD2 Q9BYW2 3/20 0.43
▸ TBK1 Q9UHD2 1/20 0.42
▸ MLLT1 Q03111 1/20 0.42
▸ RIPK1 Q13546 1/20 0.39
▸ SLC2A1 P11166 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CD38 P28907 1/20 0.38
▸ AR P10275 1/20 0.38
▸ NSD2 O96028 1/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ GABRA1 P14867 1/20 0.37
▸ SMYD3 Q9H7B4 1/20 0.37

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
SCHEMBL29721662 1.00 NUDT1 (0.53) NUDT1SETD2TBK1MLLT1RIPK1
SCHEMBL23147481 0.95 NUDT1 (0.51) NUDT1SETD2TBK1MLLT1RIPK1
SCHEMBL29721638 0.95 NUDT1 (0.51) NUDT1SETD2TBK1MLLT1RIPK1
SCHEMBL29721626 0.90 NUDT1 (0.50) NUDT1SETD2TBK1MLLT1L3MBTL1
SCHEMBL23147845 0.90 NUDT1 (0.50) NUDT1SETD2TBK1MLLT1L3MBTL1
SCHEMBL23147696 0.89 NUDT1 (0.54) NUDT1SETD2TBK1MLLT1
SCHEMBL23147474 0.89 NUDT1 (0.49) NUDT1SETD2TBK1MLLT1L3MBTL1
SCHEMBL23170105 0.87 NUDT1 (0.54) NUDT1SETD2TBK1MLLT1L3MBTL1
SCHEMBL23147850 0.87 NUDT1 (0.54) NUDT1SETD2TBK1MLLT1L3MBTL1
SCHEMBL29721455 0.87 NUDT1 (0.54) NUDT1SETD2TBK1MLLT1L3MBTL1

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 8 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 claimed
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 claimed
WO-2021062316-A1 AZAINDOLE CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS THE GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT, INC. (US) 2021-04-01 — — WO claimed
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
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
WO-2021062316-A1 AZAINDOLE CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS THE GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT, INC. (US) 2021-04-01 — — WO disclosed
WO-2021062316-A1 AZAINDOLE CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS THE GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT, INC. (US) 2021-04-01 — — WO 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 NUDT1 711/4885SETD2 1333/4885TBK1 489/4885

“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.

Send feedback