SCHEMBL2471753

SCHEMBL2471753

CCOc1cccc(-n2cnc(-c3c(-c4ccccc4)noc3C)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.53
CREBBP Q92793 2/20 0.53
BRD2 P25440 1/20 0.53
MAPT P10636 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
PTGS1 P23219 2/20 0.45
PTGS2 P35354 2/20 0.45
HTT P42858 2/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 2/20 0.41
HPGD P15428 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
FAAH O00519 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPK14 Q16539 1/20 0.39
GABRA5 P31644 1/20 0.38

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
SCHEMBL2473691 0.90 L3MBTL1 (0.48) BRD4CREBBPBRD2MAPTL3MBTL1
SCHEMBL2470757 0.86 PTGS2 (0.56) BRD4BRD2MAPTL3MBTL1TDP1
SCHEMBL2470820 0.85 PTGS2 (0.50) BRD4BRD2MAPTL3MBTL1TDP1
SCHEMBL2470861 0.84 JMJD6 (0.46) BRD4CREBBPBRD2MAPTL3MBTL1
SCHEMBL2468931 0.84 PTGS1 (0.58) MAPTL3MBTL1TDP1PTGS1PTGS2
SCHEMBL2470539 0.84 PTGS2 (0.48) BRD4MAPTL3MBTL1TDP1PTGS1
SCHEMBL2476849 0.84 PTGS2 (0.48) BRD4MAPTL3MBTL1TDP1PTGS1
SCHEMBL2472880 0.82 PTGS1 (0.46) BRD4CREBBPBRD2MAPTL3MBTL1
SCHEMBL2469006 0.81 PTGS2 (0.53) BRD4MAPTL3MBTL1TDP1PTGS1
SCHEMBL2469036 0.81 GRM5 (0.54) MAPTL3MBTL1TDP1PTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1968973-B1 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-10-05 EP claimed
EP-1968973-A2 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2008-09-17 EP claimed
US-7414061-B2 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-08-19 US claimed
US-20070161654-A1 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. 2007-07-12 US claimed
WO-2007074078-A2 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-07-05 WO claimed
EP-1968973-B1 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-10-05 EP disclosed
EP-1968973-A2 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2008-09-17 EP disclosed
US-7414061-B2 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-08-19 US disclosed
US-20070161654-A1 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. 2007-07-12 US disclosed
WO-2007074078-A2 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-07-05 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 (1 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-20070161654-A1 Aryl-isoxazol-4-yl-imidazole derivatives GABRA5, GABRA4, GABRA1 BRD4 677/4885CREBBP 358/4885BRD2 1378/4885

“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.