SCHEMBL6715316

SCHEMBL6715316

COCC1=C(C)NC(=O)N(C(=O)Oc2ccc([N+](=O)[O-])cc2)C1c1ccc(F)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CACNA1F O60840 3/20 0.44
CACNA1D Q01668 3/20 0.44
CACNA1S Q13698 3/20 0.44
CACNA1C Q13936 3/20 0.44
ADRA1D P25100 11/20 0.43
ADRA1A P35348 11/20 0.43
ADRA1B P35368 11/20 0.43
ADORA3 P0DMS8 1/20 0.38

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
SCHEMBL6193641 0.86 ADRA1D (0.54) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D
SCHEMBL7162576 0.86 ADRA1D (0.54) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D
SCHEMBL6715576 0.85 CACNA1F (0.48) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D
SCHEMBL6196834 0.84 ADRA1D (0.51) ADRA1DADRA1AADRA1B
SCHEMBL7674379 0.84 ADRA1D (0.51) ADRA1DADRA1AADRA1B
SCHEMBL6898111 0.82 CACNA1F (0.48) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D
SCHEMBL6198625 0.79 ADRA1D (0.45) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D
SCHEMBL6772155 0.78 CACNA1F (0.39) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D
SCHEMBL6772145 0.78 CACNA1F (0.39) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D
SCHEMBL6713558 0.77 CACNA1F (0.47) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D

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-20040242609-A1 Selective melanin concentrating hormone-1 (MCH1) receptor antagonists and uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2004-12-02 US disclosed
US-6720324-B2 THERAPY FOR EATING DISORDERS, SEXUAL DISORDERS, PSYCHOLOGICAL DISORDERS SYNAPTIC PHARMACEUTICAL CORPORATION 2004-04-13 US disclosed
US-20040038855-A1 DNA encoding a human melanin concentrating hormone receptor (MCH1) and uses thereof H. LUNDBECK A/S (DK) 2004-02-26 US disclosed
US-20030069261-A1 Selective melanin concentrating hormone-1 (MCH1) receptor antagonists and uses thereof H. LUNDBECK A/S (DK) 2003-04-10 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 (3 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-20040038855-A1 DNA encoding a human melanin concentrating hormone receptor (MCH1) and uses thereof MCHR1, MCHR2, MC1R CACNA1F 3536/4885CACNA1D 3176/4885CACNA1S 3415/4885
US-20040242609-A1 Selective melanin concentrating hormone-1 (MCH1) receptor antagonists and uses thereof MCHR1, MCHR2, MC4R CACNA1F 4253/4885CACNA1D 3141/4885CACNA1S 3461/4885
US-20030069261-A1 Selective melanin concentrating hormone-1 (MCH1) receptor antagonists and uses thereof MCHR1, MCHR2, MC4R CACNA1F 4253/4885CACNA1D 3141/4885CACNA1S 3461/4885

“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.