SCHEMBL6582497

SCHEMBL6582497

Cc1ccccc1S(=O)(=O)c1cc[nH]n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
KDM4E B2RXH2 5/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
ALDH1A1 P00352 5/20 0.41
HTT P42858 1/20 0.40
AKR1B1 P15121 5/20 0.40
POLB P06746 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
NPSR1 Q6W5P4 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 2/20 0.38
HSD11B1 P28845 1/20 0.38
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL22494209 0.77 AKR1B1 (0.35) AKR1B1
SCHEMBL27393122 0.76 AKR1B1 (0.37) ALDH1A1AKR1B1CYP3A4CYP2C9HPGD
SCHEMBL27390402 0.76 MEN1 (0.44) AKR1B1CYP3A4CYP2C9HSD11B1MEN1
SCHEMBL475089 0.74 ALDH1A1 (0.55) MAPTKDM4EL3MBTL1ALDH1A1HTT
SCHEMBL29468592 0.74 ALDH1A1 (0.55) MAPTKDM4EL3MBTL1ALDH1A1HTT
SCHEMBL21753445 0.74 HTR2A (0.38) MAPTKDM4EALDH1A1AKR1B1HPGD
SCHEMBL4540142 0.74 AKR1B1 (0.58) ALDH1A1AKR1B1SMN1; SMN2
SCHEMBL27529895 0.73 AKR1B1 (0.64) AKR1B1KMT2A
SCHEMBL28830409 0.72 KDM4E (0.45) MAPTKDM4EL3MBTL1ALDH1A1HTT
SCHEMBL8782170 0.72 RAPGEF4 (0.49) L3MBTL1ALDH1A1HTTAKR1B1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1257539-B1 AMINO PYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF OBESITY AND OTHER DISORDERS ORTHO MCNEIL PHARM INC (US) 2004-12-29 EP disclosed
US-6531478-B2 For therapy of eating disorder, obesity, bulimia nervosa, diabetes, binge eating, anorexia nervosa, dyslipidimia, hypertension, memory loss, epileptic seizures, migraine, sleep disturbances, pain, sexual/reproductive disorders KORDIK CHERYL P (US) 2003-03-11 US disclosed
EP-1257539-A2 AMINO PYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF OBESITY AND OTHER DISORDERS Ortho-Mcneil Pharmaceutical, Inc. (US) 2002-11-20 EP disclosed
US-20020065289-A1 Amino pyrazole derivatives useful for the treatment of obesity and other disorders KORDIK CHERYL P (US) 2002-05-30 US disclosed
WO-2001062737-A2 AMINO PYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF OBESITY AND OTHER DISORDERS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2001-08-30 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 (1 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-20020065289-A1 Amino pyrazole derivatives useful for the treatment of obesity and other disorders NPY5R, NPY1R, NPY4R MAPT 2451/4885KDM4E 2084/4885L3MBTL1 4339/4885

“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.