SCHEMBL6973924

SCHEMBL6973924

CC(C)(C)c1cc(CC(=O)Nc2cccc(Br)c2O)cc(C(C)(C)C)c1O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HPGD P15428 2/20 0.44
CYP1A2 P05177 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
GAA P10253 5/20 0.44
TDP1 Q9NUW8 1/20 0.43
NLRP3 Q96P20 2/20 0.42
AKT1 P31749 1/20 0.42
SELL P14151 2/20 0.40
SELP P16109 2/20 0.40
SELE P16581 2/20 0.40
RAB9A P51151 1/20 0.39

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
SCHEMBL7733874 0.84 HDAC3 (0.49) KMT2AMEN1ALDH1A1LMNAKDM4E
SCHEMBL6969104 0.83 GAA (0.45) KMT2AMEN1ALDH1A1LMNAKDM4E
SCHEMBL6960412 0.81 GAA (0.43) KMT2AMEN1ALDH1A1LMNACYP1A2
SCHEMBL6962364 0.79 MEN1 (0.50) KMT2AMEN1ALDH1A1LMNAKDM4E
SCHEMBL5741936 0.77 GAA (0.55) KMT2AMEN1ALDH1A1LMNAKDM4E
SCHEMBL1853620 0.75 MEN1 (0.62) KMT2AMEN1ALDH1A1LMNAKDM4E
SCHEMBL11914171 0.75 NAMPT (0.51) KMT2AMEN1ALDH1A1SMN1; SMN2GAA
SCHEMBL8078098 0.75 GAA (0.67) KMT2AMEN1ALDH1A1LMNAKDM4E
SCHEMBL14586752 0.75 GAA (0.57) KMT2AMEN1ALDH1A1LMNAKDM4E
SCHEMBL785309 0.74 NLRP3 (0.58) KMT2AMEN1ALDH1A1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0785927-B1 NOVEL BENZOXAZOLES EURO CELTIQUE SA (LU) 2003-08-27 EP disclosed
US-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US disclosed
US-6365606-B1 TREATMENT OF DISEASES WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF CYTOKINES; SIDE EFFECT REDUCTION; ISOINDOLES; BRONCHODILATOR; ANTI-INFLAMMATORY AGENT EURO-CELTIQUE, S.A. (LU) 2002-04-02 US disclosed
EP-1160247-A1 6,5-Fused aromatic ring systems having enhanced phosphodiesterae IV inhibitory activity Euro-Celtique S.A. (LU) 2001-12-05 EP disclosed
US-6075016-A 6,5-fused aromatic ring systems having enhanced phosphodiesterase IV inhibitory activity EURO-CELTIQUE S.A. (LU) 2000-06-13 US disclosed
EP-0785927-A4 NOVEL BENZOXAZOLES EURO CELTIQUE SA (LU) 1997-12-29 EP disclosed
EP-0785927-A1 NOVEL BENZOXAZOLES Euroceltique S.A. (LU) 1997-07-30 EP disclosed
WO-1996011917-A1 NOVEL BENZOXAZOLES EURO-CELTIQUE, S.A. (LU) 1996-04-25 WO disclosed