SCHEMBL6091876

SCHEMBL6091876

O/N=C(\Cc1ccncc1)c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 2/20 0.47
LTA4H P09960 1/20 0.46
CYP3A4 P08684 1/20 0.41
MAPK14 Q16539 1/20 0.41
CTBP2 P56545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
XDH P47989 2/20 0.40
DRD4 P21917 2/20 0.40
TLR4 O00206 1/20 0.40
NAMPT P43490 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
USP2 O75604 1/20 0.38
RAB9A P51151 1/20 0.38
ALOX5 P09917 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
SCHEMBL6091878 1.00 SMN1; SMN2 (0.47) SMN1; SMN2KDM4ELTA4HCYP3A4MAPK14
SCHEMBL23410797 1.00 SMN1; SMN2 (0.47) SMN1; SMN2KDM4ELTA4HCYP3A4MAPK14
SCHEMBL5095734 0.93 L3MBTL1 (0.47) SMN1; SMN2KDM4ELTA4HCTBP2L3MBTL1
SCHEMBL4459265 0.93 L3MBTL1 (0.47) SMN1; SMN2KDM4ELTA4HCTBP2L3MBTL1
SCHEMBL4459267 0.93 L3MBTL1 (0.47) SMN1; SMN2KDM4ELTA4HCTBP2L3MBTL1
SCHEMBL7423263 0.87 SMN1; SMN2 (0.59) SMN1; SMN2KDM4ECTBP2L3MBTL1XDH
SCHEMBL8865628 0.87 SMN1; SMN2 (0.59) SMN1; SMN2KDM4ECTBP2L3MBTL1XDH
SCHEMBL9324776 0.82 KDM4E (0.46) SMN1; SMN2KDM4ECYP3A4CTBP2XDH
SCHEMBL9324768 0.82 KDM4E (0.46) SMN1; SMN2KDM4ECYP3A4CTBP2XDH
SCHEMBL4586342 0.82 ALDH1A1 (0.51) SMN1; SMN2KDM4ECTBP2L3MBTL1XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230052017-A1 New compounds for treatment of diseases related to DUX4 expression Facio Intellectual Property B.V. (NL) 2023-02-16 US disclosed
EP-4065107-A1 NEW COMPOUNDS FOR TREATMENT OF DISEASES RELATED TO DUX4 EXPRESSION Facio Intellectual Property B.V. (NL) 2022-10-05 EP disclosed
WO-2021105474-A1 NEW COMPOUNDS FOR TREATMENT OF DISEASES RELATED TO DUX4 EXPRESSION Facio Intellectual Property B.V. (NL) 2021-06-03 WO disclosed
US-20060128759-A1 Substituted isoxazole derivatives and their use in pharmaceutics MERCKLE GMBH (DE) 2006-06-15 US disclosed
US-20040106793-A1 Oxazoles for treating cytokine mediated diseases SMITHKLINE BEECHAM CORPORATION 2004-06-03 US disclosed
EP-0727998-B1 OXAZOLES FOR TREATING CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORP (US) 2004-01-21 EP disclosed
EP-1306377-A2 Pyridyl-oxazoles and their use as cytokines inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2003-05-02 EP disclosed
US-20020169173-A1 Oxazoles for treating cytokine mediated diseases SMITHKLINE BEECHAM CORPORATION 2002-11-14 US disclosed
US-6288062-B1 INTERLEUKIN AND TUMOR NECROSIS FACTOR INHIBITORS; ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS; RESPIRATORY SYSTEM DISORDERS SMITHKLINE BEECHAM CORPORATION 2001-09-11 US disclosed
EP-0727998-A4 OXAZOLES FOR TREATING CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORP (US) 1997-03-19 EP disclosed
EP-0727998-A1 OXAZOLES FOR TREATING CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION (US) 1996-08-28 EP disclosed
WO-1995013067-A1 OXAZOLES FOR TREATING CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION (US) 1995-05-18 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-20040106793-A1 Oxazoles for treating cytokine mediated diseases IL2, IL17A, IL5 SMN1; SMN2 2408/4885KDM4E 4530/4885LTA4H 136/4885
US-20020169173-A1 Oxazoles for treating cytokine mediated diseases IL17A, IL4I1, IL2 SMN1; SMN2 283/4885KDM4E 4607/4885LTA4H 119/4885
US-20230052017-A1 New compounds for treatment of diseases related to DUX4 expression SMN1; SMN2, UTRN, DDX21 SMN1; SMN2 1/4885KDM4E 1310/4885LTA4H 3217/4885
US-20060128759-A1 Substituted isoxazole derivatives and their use in pharmaceutics IFNG, IRF3, IL2 SMN1; SMN2 4155/4885KDM4E 4044/4885LTA4H 657/4885

“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.