SCHEMBL585271

SCHEMBL585271

CCc1cccc2oc(C(=O)O)c(N)c12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 2/20 0.44
MCL1 Q07820 2/20 0.43
KDM4E B2RXH2 4/20 0.42
AHR P35869 1/20 0.42
ELANE P08246 2/20 0.41
GPR35 Q9HC97 1/20 0.40
NPC1 O15118 4/20 0.40
MAPT P10636 3/20 0.40
KMT2A Q03164 1/20 0.40
RAB9A P51151 3/20 0.39
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MMP2 P08253 1/20 0.36
MMP13 P45452 1/20 0.36
CLCN2 P51788 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
SCHEMBL7814199 0.83 MCL1 (0.43) EDNRAMCL1KDM4EAHRGPR35
SCHEMBL3607819 0.82 EDNRA (0.60) EDNRAMCL1KDM4EELANEGPR35
SCHEMBL1474620 0.82 GABRA1 (0.47) EDNRAMCL1KDM4EAHRELANE
SCHEMBL11194764 0.79 EDNRA (0.43) EDNRAMCL1KDM4EELANEGPR35
SCHEMBL28509698 0.78 EDNRA (0.52) EDNRAMCL1KDM4ENPC1MAPT
SCHEMBL17786596 0.73 KDM4E (0.46) EDNRAMCL1KDM4ENPC1KMT2A
SCHEMBL27593837 0.71 EDNRA (0.59) EDNRAMCL1KDM4EGPR35NPC1
SCHEMBL1474617 0.71 MAPT (0.52) EDNRAMCL1KDM4EGPR35NPC1
SCHEMBL6830612 0.71 KCNA5 (0.48) KDM4EELANEGPR35MAPTKMT2A
SCHEMBL11881889 0.71 EDNRA (0.41) EDNRAMCL1KDM4EAHRNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025233174-A1 BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2025-11-13 WO disclosed
EP-4615849-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS Boehringer Ingelheim International GmbH (DE) 2025-09-17 EP disclosed
EP-4615578-A1 CYCLIC PYRIDINE DERIVATIVES AS CGAS INHIBITORS Boehringer Ingelheim International GmbH (DE) 2025-09-17 EP disclosed
CN-120202206-A Cyclic benzimidazole derivatives as cGAS inhibitors 勃林格殷格翰国际有限公司 2025-06-24 CN disclosed
US-20240208997-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-06-27 US disclosed
US-20240189315-A1 Cyclic Pyridine Derivatives as cGAS Inhibitors BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2024-06-13 US disclosed
WO-2024099908-A1 CYCLIC PYRIDINE DERIVATIVES AS CGAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-05-16 WO disclosed
WO-2024099907-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-05-16 WO disclosed
EP-2417140-B1 INHIBITORS OF HIV REPLICATION BOEHRINGER INGELHEIM INT (DE) 2014-11-26 EP disclosed
US-8349839-B2 Inhibitors of HIV replication BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-01-08 US disclosed
EP-2417140-A1 INHIBITORS OF HIV REPLICATION Boehringer Ingelheim International GmbH (DE) 2012-02-15 EP disclosed
WO-2010115264-A1 INHIBITORS OF HIV REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 WO disclosed
US-20100261714-A1 INHIBITORS OF HIV REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 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-20240208997-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS CGAS, STING1, IFNAR1 EDNRA 3048/4885MCL1 3259/4885KDM4E 2028/4885
US-20240189315-A1 Cyclic Pyridine Derivatives as cGAS Inhibitors CGAS, STING1, IRF3 EDNRA 1426/4885MCL1 3763/4885KDM4E 1598/4885
US-20100261714-A1 INHIBITORS OF HIV REPLICATION RTF2, POLR1A, REV1 EDNRA 1800/4885MCL1 1776/4885KDM4E 1206/4885

“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.