SCHEMBL4186569

SCHEMBL4186569

CC([O])Oc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
P2RX3 P56373 1/20 0.44
PPARG P37231 5/20 0.43
PPARA Q07869 5/20 0.43
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SIGMAR1 Q99720 2/20 0.40

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
SCHEMBL6802075 0.81 POLB (0.47) POLBCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL104891 0.80 P2RX3 (0.54) POLBCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL6556332 0.80 L3MBTL1 (0.53) POLBCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL9702616 0.78 P2RX3 (0.53) POLBCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL5697814 0.78 CA1 (0.55) L3MBTL1GAANPSR1ALDH1A1KDM4E
SCHEMBL6516593 0.78 ACHE (0.46) POLBPPARGPPARANPSR1ALDH1A1
SCHEMBL10601649 0.78 POLB (0.48) POLBCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL3162462 0.76 POLB (0.47) POLBCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL8333706 0.76 POLB (0.52) POLBCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL1010865 0.76 POLB (0.52) POLBCYP1A2CYP2C9CYP2C19L3MBTL1

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242103-B2 Sulphamides for treatment of cancer MERCK SHARP & DOHME LIMITED (GB) 2012-08-14 US disclosed
US-20090197904-A1 Sulphamides for Treatment of Cancer MERCK SHARP & DOHME (UK) LIMITED (GB) 2009-08-06 US disclosed
US-7365196-B2 Sulphonamido-substituted bridged bicycloalkyl derivatives MERCK SHARP & DOHME LTD. (GB) 2008-04-29 US disclosed
EP-1885349-A2 SULPHAMIDES FOR TREATMENT OF CANCER Merck Sharp & Dohme Limited (GB) 2008-02-13 EP disclosed
EP-1268412-B8 SULPHONAMIDO-SUBSTITUTED BRIDGED BICYCLOALKYL DERIVATIVES MERCK SHARP & DOHME (GB) 2007-02-21 EP disclosed
WO-2006123185-A2 SULPHAMIDES FOR TREATMENT OF CANCER MERCK SHARP & DOHME LIMITED (GB) 2006-11-23 WO disclosed
EP-1268412-B1 SULPHONAMIDO-SUBSTITUTED BRIDGED BICYCLOALKYL DERIVATIVES MERCK SHARP & DOHME (GB) 2006-11-22 EP disclosed
US-7138400-B2 Sulfamides as gamma-secretase inhibitors MERCK SHARP & DOHME LIMITED (GB) 2006-11-21 US disclosed
EP-1334085-B1 SULFAMIDES AS GAMMA-SECRETASE INHIBITORS MERCK SHARP & DOHME (GB) 2005-08-24 EP disclosed
US-20040049038-A1 Sulfamides as gamma-secretase inhibitors MERCK SHARP & DOHME (UK) LIMITED (GB) 2004-03-11 US disclosed
US-5051447-A Applying aromatic oximes to plants, seeds or soils BASF AKTIENGESELLSCHAFT (DE) 1991-09-24 US disclosed
US-4997973-A Ortho-substituted benzyl carboxylates and fungicides containing these compounds BASF AKTIENGESELLSCHAFT (DE) 1991-03-05 US disclosed
EP-0310954-B1 ORTHO-SUBSTITUTED CARBOXYLIC ACID BENZYL ESTERS AND FUNGICIDES CONTAINING THESE COMPOUNDS BASF Aktiengesellschaft (DE) 1990-11-22 EP disclosed
US-4952720-A Ortho-substituted benzyl carboxylates and fungicides which contain these compounds BASF AKTIENGSELLSCHAFT (DE) 1990-08-28 US disclosed
EP-0337211-B1 ORTHO-SUBSTITUTED CARBOXYLIC-ACID BENZYL ESTERS AND FUNGICIDES CONTAINING THEM BASF Aktiengesellschaft (DE) 1990-07-11 EP disclosed
EP-0354571-A1 Oximethers, method for their preparation and fungicides containing them BASF Aktiengesellschaft (DE) 1990-02-14 EP disclosed
EP-0337211-A1 Ortho-substituted carboxylic-acid benzyl esters and fungicides containing them BASF Aktiengesellschaft (DE) 1989-10-18 EP disclosed
EP-0310954-A1 Ortho-substituted carboxylic acid benzyl esters and fungicides containing these compounds BASF Aktiengesellschaft (DE) 1989-04-12 EP disclosed
US-4701452-A STIMULANTS; ANTIBIOTICS HOECHST AKTIENGESELLSCHAFT (DE) 1987-10-20 US disclosed
US-4454129-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1984-06-12 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 (2 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-20090197904-A1 Sulphamides for Treatment of Cancer SDHA, SDHB, BRDT POLB 1080/4885CYP1A2 1359/4885CYP2C9 1086/4885
US-20040049038-A1 Sulfamides as gamma-secretase inhibitors BACE1, BACE2, PSEN1 POLB 2081/4885CYP1A2 2373/4885CYP2C9 3363/4885

“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.