SCHEMBL2289730

SCHEMBL2289730

O=C(O)CCc1nc2c(o1)-c1ccccc1Oc1ccccc1-2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 20/20 0.62
RXRB P28702 18/20 0.62
RXRG P48443 12/20 0.62
NR4A2 P43354 6/20 0.62
KDM4E B2RXH2 1/20 0.60
ABCC4 O15439 1/20 0.60
C5 P01031 1/20 0.60
LMNA P02545 1/20 0.60
CHRM2 P08172 1/20 0.60
CYP3A4 P08684 1/20 0.60
CHRM1 P11229 1/20 0.60
DRD2 P14416 1/20 0.60
HPGD P15428 1/20 0.60
TSHR P16473 1/20 0.60
TBXA2R P21731 1/20 0.60
NR4A1 P22736 1/20 0.60
PTGS1 P23219 1/20 0.60
HTR2A P28223 1/20 0.60
HTR2C P28335 1/20 0.60
MAPK1 P28482 1/20 0.60

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
SCHEMBL5700661 0.87 RXRA (0.49) RXRARXRBRXRGNR4A2KDM4E
SCHEMBL2293918 0.84 KDM4E (0.51) RXRARXRBRXRGNR4A2KDM4E
SCHEMBL2293345 0.81 RXRA (0.41) RXRARXRBRXRGNR4A2KDM4E
SCHEMBL2296872 0.80 RXRA (0.60) RXRARXRBRXRGNR4A2KDM4E
SCHEMBL6407346 0.77 NR4A2 (0.39) RXRARXRBRXRGNR4A2KDM4E
SCHEMBL2292267 0.77 ELANE (0.37) RXRARXRBRXRGNR4A2KDM4E
Oxaprozin SCHEMBL8191237 0.76 RXRA (1.00) RXRARXRBRXRGNR4A2KDM4E
Oxaprozin SCHEMBL3849972 0.76 RXRA (1.00) RXRARXRBRXRGNR4A2KDM4E
Oxaprozin SCHEMBL3286 0.76 RXRA (1.00) RXRARXRBRXRGNR4A2KDM4E
SCHEMBL13652909 0.74 RXRA (0.70) RXRARXRBRXRGNR4A2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1684766-B1 USE OF 3-AZA-1-OXA-DIBENZO i e,h /i AZULENES FOR THE MANUFACTURE OF PHARMACEUTICAL FORMULATIONS FOR THE TREATMENT AND PREVENTION OF CENTRAL NERVOUS SYSTEM DISEAS AND DISORDERS GLAXOSMITHKLINE ZAGREB (HR) 2007-06-27 EP claimed
US-7232815-B2 1-oxa-3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof GLAXOSMITHKLINE (HR) 2007-06-19 US claimed
US-20070111990-A1 3-Aza-1-oxa-dibenzo[e,h]azulenes for the treatment of central nervous system diseases and disorders GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB D.O.O. (HR) 2007-05-17 US claimed
EP-1492797-B1 1-OXA-3-AZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PRODUCTION THEREOF PLIVA ISTRAZIVACKI INST D O O (HR) 2006-03-15 EP claimed
US-20050148576-A1 1-Oxa-3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2005-07-07 US claimed
US-20050130956-A1 1-oxa 3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2005-06-16 US claimed
EP-4580679-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS Biohaven Therapeutics Ltd. (VG) 2025-07-09 EP disclosed
WO-2024050389-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-07 WO disclosed
US-20110200618-A1 ERBB4 INHIBITORS AND USES THEREOF IN TREATMENT OF NEUROPSYCHIATRIC DISORDERS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2011-08-18 US disclosed
WO-2009103072-A2 ERBB4 INHIBITORS AND USES THEREOF IN TREATMENT OF NEUROPSYCHIATRIC DISORDERS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2009-08-20 WO disclosed
EP-1684766-B1 USE OF 3-AZA-1-OXA-DIBENZO i e,h /i AZULENES FOR THE MANUFACTURE OF PHARMACEUTICAL FORMULATIONS FOR THE TREATMENT AND PREVENTION OF CENTRAL NERVOUS SYSTEM DISEAS AND DISORDERS GLAXOSMITHKLINE ZAGREB (HR) 2007-06-27 EP disclosed
US-7232815-B2 1-oxa-3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof GLAXOSMITHKLINE (HR) 2007-06-19 US disclosed
US-20070111990-A1 3-Aza-1-oxa-dibenzo[e,h]azulenes for the treatment of central nervous system diseases and disorders GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB D.O.O. (HR) 2007-05-17 US disclosed
EP-1492797-B1 1-OXA-3-AZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PRODUCTION THEREOF PLIVA ISTRAZIVACKI INST D O O (HR) 2006-03-15 EP disclosed
US-20050148576-A1 1-Oxa-3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2005-07-07 US disclosed
EP-1492797-A1 1-OXA-3-AZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PRODUCTION THEREOF PLIVA-ISTRAZIVACKI INSTITUT d.o.o. (HR) 2005-01-05 EP disclosed
WO-2003084964-A1 1-OXA-3-AZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PRODUCTION THEREOF PLIVA - ISTRAZIVACKI INSTITUT D.O.O. (HR) 2003-10-16 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 (4 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-20050148576-A1 1-Oxa-3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof TNF, IL1A, IL1B RXRA 2092/4885RXRB 2214/4885RXRG 2662/4885
US-20050130956-A1 1-oxa 3-aza-dibenzoazulenes as inhibitors of tumor necrosis factor production and intermediates for the production thereof TNF, IL1A, IL1B RXRA 1888/4885RXRB 2025/4885RXRG 2469/4885
US-20070111990-A1 3-Aza-1-oxa-dibenzo[e,h]azulenes for the treatment of central nervous system diseases and disorders AZI2, DBH, BCHE RXRA 2049/4885RXRB 2018/4885RXRG 2510/4885
US-20110200618-A1 ERBB4 INHIBITORS AND USES THEREOF IN TREATMENT OF NEUROPSYCHIATRIC DISORDERS ERBB4, ERBB3, ERBB2 RXRA 2231/4885RXRB 1880/4885RXRG 2132/4885

“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.