SCHEMBL3550152

SCHEMBL3550152

C=CCc1cc(Oc2ccc(Cl)cc2)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.53
GABRB2 P47870 4/20 0.53
POLB P06746 2/20 0.46
MEN1 O00255 3/20 0.43
MAPT P10636 3/20 0.43
KMT2A Q03164 3/20 0.43
GAA P10253 2/20 0.43
CNR1 P21554 2/20 0.43
CNR2 P34972 2/20 0.43
ALOX5 P09917 1/20 0.43
GABRB1 P18505 1/20 0.43
RXRA P19793 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
SIRT3 Q9NTG7 1/20 0.43
AKR1B1 P15121 2/20 0.42
XDH P47989 1/20 0.42
HPGD P15428 4/20 0.41

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
SCHEMBL1951863 0.90 GABRA1 (0.63) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL774628 0.86 GABRA1 (0.54) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL5972997 0.84 GABRA1 (0.53) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL5208440 0.84 GABRA1 (0.53) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL8635378 0.82 LTA4H (0.51) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL2490536 0.81 GABRA1 (0.66) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL8633405 0.81 GABRA1 (0.49) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL11122677 0.80 GABRA1 (0.47) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL26982529 0.79 GABRA1 (0.46) GABRA1GABRB2POLBMEN1MAPT
SCHEMBL5209444 0.79 POLB (0.58) GABRA1GABRB2POLBMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102584754-B There is the fused aromatic compounds of anti-diabetic activity SCHERING CORPORATION (US) 2016-02-03 CN disclosed
EP-1861382-B1 FUSED AROMATIC COMPOUNDS HAVING ANTI-DIABETIC ACTIVITY MERCK SHARP & DOHME (US) 2012-10-10 EP disclosed
CN-102584754-A Fused aromatic compounds having anti-diabetic activity MERCK SHARP & DOHME 2012-07-18 CN disclosed
US-7834036-B2 Fused-aromatic compounds having anti-diabetic activity MERCK SHARP & DOHME CORP (US) 2010-11-16 US disclosed
US-7807692-B2 Antidiabetic oxazolidinediones and thiazolidinediones MERCK SHARP & DOHME CORP. (US) 2010-10-05 US disclosed
US-20100168164-A1 Antidiabetic Oxazolidinediones and Thiazolidinediones MERCK SHARP & DOHME CORP. 2010-07-01 US disclosed
EP-1907381-A4 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES MERCK & CO INC (US) 2009-08-26 EP disclosed
US-20080194586-A1 Fused-Aromatic Compounds Having Anti-Diabetic Activity MERCK SHARP & DOHME LLC 2008-08-14 US disclosed
EP-1907381-A1 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES Merck & Co., Inc. (US) 2008-04-09 EP disclosed
CN-101128441-A Fused aromatic compounds having anti-diabetic activity MERCK & CO INC (US) 2008-02-20 CN disclosed
EP-1861382-A1 FUSED AROMATIC COMPOUNDS HAVING ANTI-DIABETIC ACTIVITY Merck & Co., Inc. (US) 2007-12-05 EP disclosed
US-20070173434-A1 Antidiabetic oxazolidinediones and thiazolidinediones MERCK SHARP & DOHME CORP. 2007-07-26 US disclosed
EP-1709014-B1 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES MERCK & CO INC (US) 2007-05-30 EP disclosed
WO-2007008501-A1 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES MERCK & CO., INC. (US) 2007-01-18 WO disclosed
EP-1709014-A1 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES Merck & Co., Inc. (US) 2006-10-11 EP disclosed
WO-2006096564-A1 FUSED AROMATIC COMPOUNDS HAVING ANTI-DIABETIC ACTIVITY MERCK & CO., INC. (US) 2006-09-14 WO disclosed
WO-2005070905-A1 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES MERCK & CO., INC. (US) 2005-08-04 WO disclosed
US-4391995-A 4-Phenoxy-phenoxy-alkane-carboxylic acid derivatives and process for their manufacture HOECHST AKTIENGESELLSCHAFT (DE) 1983-07-05 US disclosed
US-4301295-A ANTILIPEMIC AND ANTICHOLESTEROL AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1981-11-17 US disclosed
US-4238626-A ANTICHOLESTEROL AND ANTILIPEMIC AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1980-12-09 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 (3 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-20080194586-A1 Fused-Aromatic Compounds Having Anti-Diabetic Activity PPARG, PPARA, FABP4 GABRA1 2030/4885GABRB2 1159/4885POLB 1732/4885
US-20100168164-A1 Antidiabetic Oxazolidinediones and Thiazolidinediones PPARD, PPARA, PPARG GABRA1 1549/4885GABRB2 480/4885POLB 2151/4885
US-20070173434-A1 Antidiabetic oxazolidinediones and thiazolidinediones PPARD, PPARA, PPARG GABRA1 1845/4885GABRB2 694/4885POLB 1824/4885

“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.