SCHEMBL13054097

SCHEMBL13054097

CN(C)[C@@H]1CCN(c2nc3ccc(NC(=O)/C=C/c4ccc(F)c(Cl)c4)cc3s2)C1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.45
MAPT P10636 5/20 0.44
KCNH2 Q12809 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL3748665 1.00 MCHR1 (0.45) MCHR1MAPTKCNH2SMN1; SMN2
SCHEMBL3748667 1.00 MCHR1 (0.45) MCHR1MAPTKCNH2SMN1; SMN2
SCHEMBL3759114 0.93 MCHR1 (0.46) MCHR1MAPTKCNH2SMN1; SMN2
SCHEMBL3759111 0.93 MCHR1 (0.46) MCHR1MAPTKCNH2SMN1; SMN2
SCHEMBL13054096 0.93 MCHR1 (0.46) MCHR1MAPTKCNH2SMN1; SMN2
SCHEMBL3744473 0.93 MAPT (0.43) MCHR1MAPTKCNH2
SCHEMBL3744471 0.93 MAPT (0.43) MCHR1MAPTKCNH2
SCHEMBL13054111 0.93 MAPT (0.43) MCHR1MAPTKCNH2
SCHEMBL4642923 0.91 MCHR1 (0.53) MCHR1MAPTKCNH2
SCHEMBL13054103 0.91 MCHR1 (0.53) MCHR1MAPTKCNH2

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-7838543-B2 Melanin Concentrating Hormone Receptor 1; Obesity; 4'-Fluoro-biphenyl-4-carboxylic acid {2-[(2-dimethylamino-ethyl)-methyl-amino]-benzothiazol-6-yl}amide; 4-Cyclohexyl-N-{2-[(2-dimethylamino-ethyl)-methyl-amino]-benzooxazol-5-yl}-benzamide; 2-aminobenzoxazoles or 2-aminobenzothiazoles ELI LILLY AND COMPANY (US) 2010-11-23 US disclosed
US-7838543-B2 Melanin Concentrating Hormone Receptor 1; Obesity; 4'-Fluoro-biphenyl-4-carboxylic acid {2-[(2-dimethylamino-ethyl)-methyl-amino]-benzothiazol-6-yl}amide; 4-Cyclohexyl-N-{2-[(2-dimethylamino-ethyl)-methyl-amino]-benzooxazol-5-yl}-benzamide; 2-aminobenzoxazoles or 2-aminobenzothiazoles ELI LILLY AND COMPANY (US) 2010-11-23 US disclosed
US-20090170913-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY 2009-07-02 US disclosed
US-20090170913-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY 2009-07-02 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-20090170913-A1 NOVEL MCH RECEPTOR ANTAGONISTS MCHR1, MCHR2, MC1R MCHR1 1/4885MAPT 1507/4885KCNH2 1963/4885

“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.