SCHEMBL7246089

SCHEMBL7246089

Cc1ccc(-n2nc(-c3ccc(NS(=O)(=O)c4cccc([N+](=O)[O-])c4)cc3)cc2N)cc1

nearest known ligand 0.82

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 17/20 0.82
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
TP53 P04637 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
MAPT P10636 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL6582985 0.91 NPY5R (1.00) NPY5RMEN1NPC1TP53CYP1A2
SCHEMBL7247426 0.85 NPY5R (1.00) NPY5RMEN1NPC1TP53CYP1A2
SCHEMBL6581818 0.83 NPY5R (1.00) NPY5RMEN1NPC1TP53CYP1A2
SCHEMBL13970848 0.81 ALDH1A1 (0.71) MEN1CYP1A2CYP3A4MAPTCYP2C9
SCHEMBL6585661 0.80 NPY5R (1.00) NPY5R
SCHEMBL6582516 0.80 NPY5R (0.76) NPY5RMEN1NPC1TP53CYP1A2
SCHEMBL7249344 0.74 NPY5R (0.68) NPY5RMAPT
SCHEMBL10090765 0.71 ALDH1A1 (0.67) MEN1MAPTKMT2AALDH1A1
SCHEMBL6582623 0.71 NPY5R (0.83) NPY5RMAPT
SCHEMBL30229690 0.70 RAB9A (0.67) NPY5RMEN1NPC1TP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
EP-1257539-A2 AMINO PYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF OBESITY AND OTHER DISORDERS Ortho-Mcneil Pharmaceutical, Inc. (US) 2002-11-20 EP claimed
US-20020065289-A1 Amino pyrazole derivatives useful for the treatment of obesity and other disorders KORDIK CHERYL P (US) 2002-05-30 US claimed
WO-2001062737-A2 AMINO PYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF OBESITY AND OTHER DISORDERS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2001-08-30 WO claimed

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 NPY5R 1/4885MEN1 2836/4885NPC1 3099/4885

“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.