SCHEMBL3276920

SCHEMBL3276920

O=C1c2ccc(Cl)cc2CC1S(=O)(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.44
HTR2A P28223 6/20 0.40
HTR2C P28335 6/20 0.40
HTR1A P08908 4/20 0.40
HTR7 P34969 4/20 0.40
DRD2 P14416 3/20 0.40
HTR2B P41595 3/20 0.40
DRD3 P35462 3/20 0.40
HRH1 P35367 1/20 0.40
MAPT P10636 2/20 0.40
S100A4 P26447 2/20 0.39
DRD4 P21917 3/20 0.38
SIGMAR1 Q99720 3/20 0.38
KIF18A Q8NI77 1/20 0.37
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SLC6A4 P31645 1/20 0.36
ACHE P22303 2/20 0.36
CYP19A1 P11511 1/20 0.35

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
SCHEMBL16738816 0.82 ACHE (0.49) METAP1MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL2908472 0.80 METAP1 (0.52) METAP1HTR2AHTR2CHTR1AHTR7
SCHEMBL3270736 0.71 METAP1 (0.46) METAP1HTR2AHTR2CHTR1AHTR7
SCHEMBL28619352 0.71 ACHE (0.47) METAP1MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL29924661 0.70 ACHE (0.44) METAP1HTR2AHTR2CMAPTALDH1A1
SCHEMBL28619348 0.70 ACHE (0.44) METAP1HTR2AHTR2CMAPTALDH1A1
SCHEMBL316167 0.70 MAPT (0.51) HTR2AHTR2CHTR1ADRD2HTR2B
SCHEMBL7590593 0.70 METAP1 (0.54) METAP1HTR2AHTR2CHTR1AHTR7
SCHEMBL29620996 0.70 METAP1 (0.58) METAP1HTR2AHTR2CHTR1AHTR7
SCHEMBL3134915 0.70 METAP1 (0.58) METAP1HTR2AHTR2CHTR1AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1425267-B1 C2-SUBSTITUTED INDANE-1-ONES AND THEIR DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS SANOFI AVENTIS DEUTSCHLAND (DE) 2010-06-30 EP disclosed
US-6946492-B2 Use of C2-substituted indan-1-one systems for preparing medicaments for the treatment of obesity AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-09-20 US disclosed
US-6762326-B2 SUCH AS 5-CHLORO-2-METHYLSULFANYLINDAN-1-ONE FOR WEIGHT CONTROL/DIETETICS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-07-13 US disclosed
EP-1424999-A1 USE OF C2-SUBSTITUTED INDANE-1-ONE SYSTEMS FOR PRODUCING MEDICAMENTS FOR THE PROPHYLAXIS OR TREATMENT OF OBESITY Aventis Pharma Deutschland GmbH (DE) 2004-06-09 EP disclosed
EP-1425267-A2 C2-SUBSTITUTED INDANE-1-ONES AND THEIR DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS Aventis Pharma Deutschland GmbH (DE) 2004-06-09 EP disclosed
US-20030134882-A1 Use of C2-substituted indan-1-one systems for preparing medicaments for the prophylaxis or treatment of obesity SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-07-17 US disclosed
US-20030130345-A1 C2-substituted idan-1-ones and their derivatives, processes for their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-07-10 US disclosed
WO-2003020677-A2 C2-SUBSTITUTED INDANE-1-ONES AND THEIR DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-03-13 WO disclosed
WO-2003020256-A1 USE OF C2-SUBSTITUTED INDANE-1-ONE SYSTEMS FOR PRODUCING MEDICAMENTS FOR THE PROPHYLAXIS OR TREATMENT OF OBESITY AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-03-13 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 (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-20030134882-A1 Use of C2-substituted indan-1-one systems for preparing medicaments for the prophylaxis or treatment of obesity GPR119, CPT1A, IDO1 METAP1 169/4885HTR2A 1416/4885HTR2C 1197/4885
US-20030130345-A1 C2-substituted idan-1-ones and their derivatives, processes for their preparation and their use as pharmaceuticals SLC10A2, ANO1, CYP1B1 METAP1 2696/4885HTR2A 1468/4885HTR2C 775/4885

“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.