SCHEMBL6711151

SCHEMBL6711151

O=C(O)NCCCN1CCC(c2cc(F)c(F)c(F)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 16/20 0.55
CCR2 P41597 2/20 0.53
ADRA1B P35368 15/20 0.52
ADRA1D P25100 14/20 0.52
HRH1 P35367 2/20 0.48
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48

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
SCHEMBL6848549 0.83 CCR2 (0.50) ADRA1ACCR2ADRA1BADRA1DHRH1
SCHEMBL6646061 0.78 CCR2 (0.42) ADRA1ACCR2
SCHEMBL6222128 0.73 DRD2 (0.66)
SCHEMBL21068738 0.73 TP53 (0.44) ADRA1AADRA1BADRA1D
SCHEMBL7063425 0.72 ADRA1D (0.47) ADRA1ACCR2ADRA1BADRA1D
SCHEMBL25404049 0.72 CCR3 (0.62) HRH1
SCHEMBL21815092 0.71 GNAI3 (0.46) ADRA1AADRA1BADRA1D
SCHEMBL14587471 0.71 ADRA1D (0.63) ADRA1AADRA1BADRA1D
SCHEMBL7067307 0.69 DRD2 (0.60) ADRA1ACCR2ADRA1BADRA1D
SCHEMBL27234242 0.69 TP53 (0.41) ADRA1AADRA1BADRA1D

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-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-20030077701-A1 DNA encoding a human melanin concentrating hormone receptor (MCH1) and uses thereof H. LUNDBECK A/S (DK) 2003-04-24 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 ADRA1A 88/4885CCR2 470/4885ADRA1B 143/4885
US-20030077701-A1 DNA encoding a human melanin concentrating hormone receptor (MCH1) and uses thereof MCHR1, MCHR2, MC1R ADRA1A 224/4885CCR2 513/4885ADRA1B 306/4885
US-20030069261-A1 Selective melanin concentrating hormone-1 (MCH1) receptor antagonists and uses thereof MCHR1, MCHR2, MC4R ADRA1A 161/4885CCR2 420/4885ADRA1B 156/4885

“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.