SCHEMBL1748229

SCHEMBL1748229

CS(=O)(=O)c1nc2ccc(Cl)cc2o1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.53
FBP1 P09467 8/20 0.49
PSMB8 P28062 1/20 0.49
PSMB5 P28074 1/20 0.49
S1PR3 Q99500 1/20 0.43
SNCA P37840 1/20 0.40
MAPT P10636 4/20 0.40
RAB9A P51151 1/20 0.40
SOS1 Q07889 1/20 0.40
LMNA P02545 3/20 0.39
TP53 P04637 3/20 0.39
POLB P06746 2/20 0.39
XDH P47989 1/20 0.38
NLRP3 Q96P20 1/20 0.38
CCR2 P41597 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
SCHEMBL1748081 0.81 KDM4E (0.53) FBP1MAPTRAB9ALMNATP53
SCHEMBL1748264 0.80 MAPT (0.41) FBP1MAPTLMNATP53
SCHEMBL29119767 0.80 DAGLA (0.38) FBP1MAPTLMNATP53POLB
SCHEMBL1748246 0.78 APP (0.52) FBP1MAPTRAB9ALMNATP53
SCHEMBL27617029 0.76 PIK3CG (0.45) PIK3CGFBP1PSMB8PSMB5S1PR3
SCHEMBL305334 0.75 LMNA (0.53) PSMB8MAPTRAB9ALMNATP53
SCHEMBL1748015 0.74 SMN1; SMN2 (0.37) FBP1MAPTRAB9ATP53
SCHEMBL22382595 0.73 FBP1 (0.42) FBP1MAPTRAB9ALMNATP53
SCHEMBL2056293 0.73 PIK3CG (0.61) PIK3CGFBP1PSMB8PSMB5S1PR3
SCHEMBL9252784 0.73 PIK3CG (0.61) PIK3CGFBP1PSMB8PSMB5S1PR3

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-8013166-B2 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity BAYER HEALTHCARE LLC (US) 2011-09-06 US disclosed
EP-1633722-B1 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BAYER HEALTHCARE LLC (US) 2011-08-03 EP disclosed
US-7968576-B2 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity SMITH ROGER A 2011-06-28 US disclosed
US-20090270468-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity SMITH ROGER 2009-10-29 US disclosed
US-20090253762-A1 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY SMITH ROGER 2009-10-08 US disclosed
US-20090197795-A1 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BAYER HEALTHCARE LLC (US) 2009-08-06 US disclosed
US-7423156-B2 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2008-09-09 US disclosed
US-20060194859-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2006-08-31 US disclosed
US-7091228-B2 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2006-08-15 US disclosed
US-20040224997-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION 2004-11-11 US disclosed
EP-0044497-A2 Process for the production of heterocyclic substituted derivatives of 4-oxyphenoxy-alkane-carbonic acid HOECHST AKTIENGESELLSCHAFT (DE) 1982-01-27 EP 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-20040224997-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity FABP4, GPR119, LIPC PIK3CG 1938/4885FBP1 1708/4885PSMB8 3055/4885
US-20060194859-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity FABP4, GPR119, LIPC PIK3CG 1938/4885FBP1 1708/4885PSMB8 3055/4885
US-20090270468-A1 Preparation and use of aryl alkyl acid derivatives for the treatment of obesity FABP4, GPR119, LIPC PIK3CG 1938/4885FBP1 1708/4885PSMB8 3055/4885
US-20090197795-A1 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY FABP4, GPR119, LIPC PIK3CG 1938/4885FBP1 1708/4885PSMB8 3055/4885
US-20090253762-A1 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY FABP4, GPR119, LIPC PIK3CG 1938/4885FBP1 1708/4885PSMB8 3055/4885

“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.