SCHEMBL2482452

SCHEMBL2482452

Cn1c(-c2ccncc2)cc2onc(-c3ccccc3)c2c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 1.00
NPC1 O15118 6/20 0.88
RAB9A P51151 6/20 0.88
CASP3 P42574 1/20 0.88
SENP8 Q96LD8 1/20 0.88
SENP7 Q9BQF6 1/20 0.88
SENP6 Q9GZR1 1/20 0.88
MITF O75030 1/20 0.78
TSHR P16473 1/20 0.69
DCTPP1 Q9H773 1/20 0.69

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
SCHEMBL6069179 1.00 NR4A2 (1.00) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL17965446 0.94 NPC1 (0.89) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL3663640 0.94 NPC1 (1.00) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL5532304 0.91 NPC1 (0.95) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL6069151 0.89 NR4A2 (0.80) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL11646682 0.88 NPC1 (0.79) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL6069469 0.88 NPC1 (0.79) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL2482092 0.88 NPC1 (1.00) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL11409495 0.88 NPC1 (1.00) NR4A2NPC1RAB9ACASP3SENP8
SCHEMBL11420574 0.86 NPC1 (0.85) NR4A2NPC1RAB9ACASP3SENP8

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376079-B1 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS VAN ANDEL RES INST (US) 2016-08-10 EP claimed
US-8173670-B2 Methods of using substituted isoxazolo pyridinones as dissociated glucocorticoids VAN ANDEL RESEARCH INSTITUTE (US) 2012-05-08 US claimed
EP-2376079-A1 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS Van Andel Research Institute (US) 2011-10-19 EP claimed
US-20110251211-A9 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-10-13 US claimed
WO-2010083218-A1 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS VAN ANDEL RESEARCH INSTITUTE (US) 2010-07-22 WO claimed
US-20100179167-A1 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS VAN ANDEL RESEARCH INSTITUTE 2010-07-15 US claimed
EP-2376079-B1 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS VAN ANDEL RES INST (US) 2016-08-10 EP disclosed
EP-2376079-B1 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS VAN ANDEL RES INST (US) 2016-08-10 EP disclosed
US-8173670-B2 Methods of using substituted isoxazolo pyridinones as dissociated glucocorticoids VAN ANDEL RESEARCH INSTITUTE (US) 2012-05-08 US disclosed
US-8173670-B2 Methods of using substituted isoxazolo pyridinones as dissociated glucocorticoids VAN ANDEL RESEARCH INSTITUTE (US) 2012-05-08 US disclosed
US-8173670-B2 Methods of using substituted isoxazolo pyridinones as dissociated glucocorticoids VAN ANDEL RESEARCH INSTITUTE (US) 2012-05-08 US disclosed
EP-2376079-A1 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS Van Andel Research Institute (US) 2011-10-19 EP disclosed
US-20110251211-A9 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-10-13 US disclosed
US-20040248893-A1 Isoxazolopyridinones NOVARTIS AG (CH) 2004-12-09 US disclosed
US-20040176407-A1 Novel isoxazolopyridone derivatives and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-09-09 US disclosed
EP-1418912-A2 ISOXAZOLOPYRIDINONES Novartis AG (CH) 2004-05-19 EP disclosed
EP-1408042-A1 NOVEL ISOXAZOLOPYRIDONE DERIVATIVES AND USE THEREOF BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-04-14 EP disclosed
WO-2003015780-A2 ISOXAZOLOPYRIDINONES AND USE THEREOF IN THE TREATMENT OF PARKINSON'S DISEASE NOVARTIS AG (CH) 2003-02-27 WO disclosed
US-4124714-A TRANQUILIZERS, SLEEP INDUCERS, MUSCLE RELAXANTS, NEUROLEPTICS, ANTIULCER AGENTS SANDOZ, INC. (US) 1978-11-07 US disclosed
US-4064251-A TRANQUILIZERS, SLEEP INDUCERS, MUSCLE RELAXANTS SANDOZ, INC. (US) 1977-12-20 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 (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-20040248893-A1 Isoxazolopyridinones XDH, NPY1R, TBXA2R NR4A2 2718/4885NPC1 3047/4885RAB9A 2041/4885
US-20100179167-A1 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS NR3C1, NR3C2, PDXK NR4A2 67/4885NPC1 4721/4885RAB9A 4513/4885
US-20110251211-A9 METHODS OF USING SUBSTITUTED ISOXAZOLO PYRIDINONES AS DISSOCIATED GLUCOCORTICOIDS NR3C1, NR3C2, PDXK NR4A2 67/4885NPC1 4721/4885RAB9A 4513/4885
US-20040176407-A1 Novel isoxazolopyridone derivatives and their use GRIN2A, GRM2, GRM1 NR4A2 230/4885NPC1 657/4885RAB9A 756/4885

“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.