SCHEMBL7065101

SCHEMBL7065101

COC1=C(C)N(C)C(=O)N(N(C=O)CCCN2CCC(c3ccccc3)CC2)C1c1ccc2nonc2c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 7/20 0.38
ADRA1A P35348 7/20 0.38
ADRA1B P35368 7/20 0.38
OPRM1 P35372 2/20 0.37
SIGMAR1 Q99720 4/20 0.35
DRD2 P14416 2/20 0.34
PARP1 P09874 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
APP P05067 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL6713785 0.81 ADRA1D (0.51) ADRA1DADRA1AADRA1BOPRM1DRD2
SCHEMBL6770595 0.81 ADRA1D (0.54) ADRA1DADRA1AADRA1BOPRM1
Hydrochloric Acid SCHEMBL6642002 0.81 ADRA1D (0.54) ADRA1DADRA1AADRA1BOPRM1
SCHEMBL6645059 0.68 ADRA1A (0.66) ADRA1DADRA1AADRA1B
SCHEMBL6718413 0.67 ADRA1D (0.68) ADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL6767632 0.67 ADRA1D (0.67) ADRA1DADRA1AADRA1B
SCHEMBL6713792 0.63 ADRA1D (0.42) ADRA1DADRA1AADRA1BOPRM1DRD2
Hydrochloric Acid SCHEMBL6646907 0.63 ADRA1A (0.55) ADRA1DADRA1AADRA1BDRD2
Hydrochloric Acid SCHEMBL7521827 0.60 OPRM1 (0.58) OPRM1SIGMAR1DRD2
Hydrochloric Acid SCHEMBL6688186 0.59 OPRM1 (0.43) ADRA1DADRA1AADRA1BOPRM1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030082623-A1 DNA encoding a human melanin concentrating hormone receptor (MCH1) and uses thereof H. LUNDBECK A/S (DK) 2003-05-01 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20030082623-A1 DNA encoding a human melanin concentrating hormone receptor (MCH1) and uses thereof MCHR1, MCHR2, MC1R ADRA1D 247/4885ADRA1A 224/4885ADRA1B 306/4885
US-20030077701-A1 DNA encoding a human melanin concentrating hormone receptor (MCH1) and uses thereof MCHR1, MCHR2, MC1R ADRA1D 247/4885ADRA1A 224/4885ADRA1B 306/4885

“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.