SCHEMBL7032033

SCHEMBL7032033

COc1ccc(C(=O)Cl)c(Cl)c1OC

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
PDE4D Q08499 3/20 0.46
POLB P06746 2/20 0.43
MCL1 Q07820 1/20 0.42
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 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
SCHEMBL2817995 0.85 TDP1 (0.66) MAPTTDP1PDE4DPOLBMAPK1
SCHEMBL31346670 0.85 MAPT (0.51) MAPTTDP1PDE4DPOLBMCL1
SCHEMBL222062 0.85 MAPT (0.55) MAPTTDP1PDE4DMCL1MEN1
SCHEMBL8492183 0.85 POLB (0.42) MAPTTDP1PDE4DPOLBMCL1
SCHEMBL10407306 0.84 TDP1 (0.50) MAPTTDP1PDE4DPOLBMCL1
SCHEMBL23067280 0.83 CTSD (0.54) MAPTTDP1PDE4DLMNAMEN1
SCHEMBL7696483 0.82 MAPT (0.40) MAPTTDP1PDE4DPOLBMCL1
SCHEMBL1748844 0.81 RAB9A (0.42) MAPTTDP1PDE4DLMNAMAPK1
SCHEMBL11281015 0.81 ALDH1A1 (0.38) MAPTTDP1PDE4DPOLBLMNA
SCHEMBL7696487 0.81 MEN1 (0.40) MAPTTDP1PDE4DSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240270762-A1 PENICILLIN-BINDING PROTEIN INHIBITORS SPRING MILL PHARMA, INC. 2024-08-15 US disclosed
EP-4347607-A1 PENICILLIN-BINDING PROTEIN INHIBITORS Venatorx Pharmaceuticals, Inc. (US) 2024-04-10 EP disclosed
CN-117693511-A Penicillin binding protein inhibitors 维纳拓尔斯制药公司 2024-03-12 CN disclosed
US-20230114728-A1 PENICILLIN-BINDING PROTEIN INHIBITORS VenatoRx Pharmaceuticals, Inc. 2023-04-13 US disclosed
WO-2021108023-A1 PENICILLIN-BINDING PROTEIN INHIBITORS VenatoRx Pharmaceuticals, Inc. (US) 2021-06-03 WO disclosed
CN-110498784-A A kind of Nobiletin derivative or its pharmaceutically acceptable salt and its preparation method and application ZHIYUAN MEDICINE TECH QINGYUAN CO LTD 2019-11-26 CN disclosed
US-20030229076-A1 Substituted imidazoles as selective modulators of bradykinin B2 receptors RACHWAL STANISLAW (US) 2003-12-11 US disclosed
US-6509366-B2 Substituted imidazoles as selective modulators of Bradykinin B2 receptors NEUROGEN CORPORATION 2003-01-21 US disclosed
US-20020151550-A1 Aryl and heteroaryl fused aminoalkyl-imidazole derivatives: selective modulators of bradykinin B2 receptors NEUROGEN CORPORATION (US) 2002-10-17 US disclosed
US-20020115693-A1 Substituted imidazoles as selective modulators of bradykinin B2 receptors NEUROGEN CORPORATION 2002-08-22 US disclosed
US-6420365-B1 Imidazopyridines and related derivatives as selective modulators of bradykinin B2 receptors NEUROGEN CORPORATION 2002-07-16 US disclosed
US-6358949-B1 CARDIOVASCULAR AND SEXUAL DISORDERS; DIABETES, KIDNEY DISEASE, LIVER CIRRHOSIS; ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIASTHMATICS NEUROGEN CORPORATION 2002-03-19 US disclosed
WO-2001056995-A1 SUBSTITUTED IMIDAZOLES AS SELECTIVE MODULATORS OF BRADYKININ B2 RECEPTORS NUEROGEN CORPORATION (US) 2001-08-09 WO disclosed
WO-2001053298-A1 IMIDAZOPYRIDINES AND RELATED AZACYCLIC DERIVATIVES AS SELECTIVE MODULATORS OF BRADYKININ B2 RECEPTORS NEUROGEN CORPORATION (US) 2001-07-26 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 (5 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-20030229076-A1 Substituted imidazoles as selective modulators of bradykinin B2 receptors BDKRB2, BDKRB1, KISS1R MAPT 3175/4885TDP1 3929/4885PDE4D 2692/4885
US-20020151550-A1 Aryl and heteroaryl fused aminoalkyl-imidazole derivatives: selective modulators of bradykinin B2 receptors BDKRB2, BDKRB1, HRH2 MAPT 3419/4885TDP1 4305/4885PDE4D 1877/4885
US-20240270762-A1 PENICILLIN-BINDING PROTEIN INHIBITORS PEPD, BPGM, EBPL MAPT 3146/4885TDP1 1223/4885PDE4D 2819/4885
US-20020115693-A1 Substituted imidazoles as selective modulators of bradykinin B2 receptors BDKRB2, BDKRB1, KISS1R MAPT 3044/4885TDP1 3822/4885PDE4D 2642/4885
US-20230114728-A1 PENICILLIN-BINDING PROTEIN INHIBITORS PEPD, BPGM, EBPL MAPT 3146/4885TDP1 1223/4885PDE4D 2819/4885

“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.