SCHEMBL5128317

SCHEMBL5128317

CC(c1cccc(OCc2ccccc2)c1)N1CCc2ccccc2C1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.60
PRMT5 O14744 4/20 0.54
WDR77 Q9BQA1 4/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
OGA O60502 1/20 0.50
BCHE P06276 1/20 0.46
CARM1 Q86X55 1/20 0.44
CYP2D6 P10635 3/20 0.44
HRH1 P35367 1/20 0.44

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
SCHEMBL5131480 0.88 REV1 (0.57) HRH3
SCHEMBL19266658 0.87 HRH3 (0.54) HRH3PRMT5WDR77L3MBTL1OGA
SCHEMBL5128246 0.87 HRH3 (0.60) HRH3PRMT5WDR77L3MBTL1OGA
SCHEMBL5128540 0.84 OGA (0.55) PRMT5WDR77OGACARM1CYP2D6
SCHEMBL15131063 0.83 OGA (0.56) PRMT5WDR77OGA
SCHEMBL5131372 0.81 HRH3 (0.51) HRH3PRMT5WDR77L3MBTL1OGA
SCHEMBL5128323 0.78 OGA (0.51) PRMT5WDR77OGA
SCHEMBL30509641 0.77 HRH3 (0.50) HRH3PRMT5WDR77BCHE
SCHEMBL5120634 0.77 OGA (0.50) HRH3PRMT5WDR77L3MBTL1OGA
SCHEMBL5130916 0.76 REV1 (0.65) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues NEUROGEN CORPORATION 2008-07-03 US claimed
WO-2005077903-A2 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED TETRAHYDROISOQUINOLINE ANALOGUES NEUROGEN CORPORATION (US) 2005-08-25 WO claimed
US-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues NEUROGEN CORPORATION 2008-07-03 US disclosed
US-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues NEUROGEN CORPORATION 2008-07-03 US disclosed
US-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues NEUROGEN CORPORATION 2008-07-03 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-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues MCHR1, MCHR2, MC1R HRH3 88/4885PRMT5 242/4885WDR77 1025/4885

“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.