SCHEMBL13797202

SCHEMBL13797202

Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NC[C@H]1CC[C@@H](Nc2nc(N(C)C)c3ccccc3n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 6/20 0.53
▸ MCHR1 Q99705 11/20 0.52
▸ ADRA2A P08913 9/20 0.52
▸ PPARA Q07869 3/20 0.51
▸ CHRM4 P08173 1/20 0.50
▸ HTR1A P08908 1/20 0.48
▸ ADRA1A P35348 1/20 0.48
▸ HRH1 P35367 1/20 0.48
▸ HTR2B P41595 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL13794393 0.85 MCHR1 (0.49) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13793895 0.85 MCHR1 (0.57) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13797103 0.84 NPY5R (0.69) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13794305 0.84 MCHR1 (0.56) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13797200 0.83 NPY5R (0.55) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13794668 0.83 NPY5R (0.49) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13793870 0.82 MCHR1 (0.60) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13794297 0.82 MCHR1 (0.58) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13794300 0.82 MCHR1 (0.58) NPY5RMCHR1ADRA2AHTR1AADRA1A
SCHEMBL13794282 0.81 MCHR1 (0.57) NPY5RMCHR1ADRA2AHTR1AADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
US-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
US-20070037836-A1 Melanin concentrating hormone; obesity and related disorders, anxiety, or depression; trans-4-Bromo-N-{4-[(4-dimethylamino-quinazolin-2-ylamino)-methyl]-cyclohexylmethyl}-2-trifluoromethoxy-benzenesulfonamide TAISHO PHARMACEUTICAL CO., LTD. (JP) 2007-02-15 — — 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 (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-20070037836-A1 Melanin concentrating hormone; obesity and related disorders, anxiety, or depression; trans-4-Bromo-N-{4-[(4-dimethylamino-quinazolin-2-ylamino)-methyl]-cyclohexylmethyl}-2-trifluoromethoxy-benzenesulfonamide MCHR1, MCHR2, MC4R NPY5R 11/4885MCHR1 1/4885ADRA2A 131/4885

“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.

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