SCHEMBL1283804

SCHEMBL1283804

CC(=O)c1ccc(OCCc2ccc(Cl)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.72
MAOA P21397 4/20 0.72
L3MBTL1 Q9Y468 1/20 0.62
GAA P10253 1/20 0.60
PPARD Q03181 2/20 0.54
PPARA Q07869 2/20 0.54
PPARG P37231 1/20 0.54
NR4A2 P43354 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
HRH3 Q9Y5N1 1/20 0.51
KMT2A Q03164 1/20 0.51
ATM Q13315 1/20 0.51
PTGDR2 Q9Y5Y4 1/20 0.50

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
SCHEMBL18477949 0.89 MAOB (0.73) MAOBMAOAL3MBTL1GAANR4A2
SCHEMBL4374627 0.86 NR4A2 (0.71) MAOBMAOAPPARDPPARAPPARG
SCHEMBL1284312 0.85 KMT2A (0.61) MAOBMAOAL3MBTL1GAAPPARD
SCHEMBL4364274 0.85 MAPT (0.66) MAOBMAOAL3MBTL1PPARDPPARA
SCHEMBL9778577 0.84 MAOB (1.00) MAOBMAOAL3MBTL1NR4A2ALDH1A1
SCHEMBL6957386 0.84 MAOB (0.71) MAOBL3MBTL1GAAPPARGALDH1A1
SCHEMBL9038241 0.83 MAPT (0.68) MAOBMAOAL3MBTL1GAAALDH1A1
SCHEMBL30903738 0.81 MAOA (0.49) MAOBMAOAL3MBTL1GAAPPARD
SCHEMBL18477943 0.81 L3MBTL1 (0.66) MAOBMAOAL3MBTL1GAAALDH1A1
SCHEMBL7987719 0.81 PPARA (0.59) MAOBMAOAL3MBTL1GAAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088778-A1 AZOLE DERIVATIVES AND FUSED BICYCLIC AZOLE DERIVATIVES AS THERAPEUTIC AGENTS TRANSTECH PHARMA, INC. (US) 2012-04-12 US disclosed
EP-1482931-B1 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE TRANSTECH PHARMA INC (US) 2011-10-19 EP disclosed
US-20100256119-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2010-10-07 US disclosed
US-7737285-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2010-06-15 US disclosed
US-7714013-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2010-05-11 US disclosed
US-7361678-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2008-04-22 US disclosed
US-20070213347-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA (US) 2007-09-13 US disclosed
US-20070021386-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA (US) 2007-01-25 US disclosed
EP-1482931-A2 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE Transtech Pharma, Inc. (US) 2004-12-08 EP disclosed
US-20040082542-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-04-29 US disclosed
WO-2003075921-A2 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE TRANSTECH PHARMA, INC. (US) 2003-09-18 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 (5 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-20100256119-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B MAOB 2425/4885MAOA 2253/4885L3MBTL1 4864/4885
US-20040082542-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B MAOB 2397/4885MAOA 2094/4885L3MBTL1 4864/4885
US-20070021386-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B MAOB 2307/4885MAOA 2216/4885L3MBTL1 4861/4885
US-20120088778-A1 AZOLE DERIVATIVES AND FUSED BICYCLIC AZOLE DERIVATIVES AS THERAPEUTIC AGENTS AGER, S100A4, S100B MAOB 2307/4885MAOA 2216/4885L3MBTL1 4861/4885
US-20070213347-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B MAOB 2307/4885MAOA 2216/4885L3MBTL1 4861/4885

“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.