SCHEMBL2796276

SCHEMBL2796276

CC1CCC(C2NCCc3ccccc32)CC1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRCP P42785 8/20 0.71
OPRM1 P35372 1/20 0.49
GAA P10253 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
MEN1 O00255 1/20 0.46
GID4 Q8IVV7 1/20 0.43
SLC22A1 O15245 1/20 0.43
RECQL P46063 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL2796275 1.00 PRCP (0.71) PRCPOPRM1GAAHTR2AHTR2C
SCHEMBL1738261 0.92 PRCP (0.83) PRCPGAAHTR2AHTR2CHTR2B
SCHEMBL28083503 0.85 PRCP (0.90) PRCPOPRM1GAAMEN1SLC22A1
SCHEMBL3865487 0.85 PRCP (0.97) PRCPOPRM1GAAMEN1SLC22A1
SCHEMBL29768302 0.83 PRCP (1.00) PRCPOPRM1GAAMEN1SLC22A1
SCHEMBL2793867 0.83 PRCP (1.00) PRCPOPRM1GAAMEN1SLC22A1
SCHEMBL2795999 0.83 PRCP (1.00) PRCPOPRM1GAAMEN1SLC22A1
SCHEMBL1011373 0.83 PRCP (1.00) PRCPOPRM1GAAMEN1SLC22A1
Hydrochloric Acid SCHEMBL2790424 0.82 PRCP (0.97) PRCPOPRM1GAAMEN1SLC22A1
SCHEMBL30032724 0.81 PRCP (0.71) PRCPOPRM1GAAHTR2AHTR2C

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
EP-2149560-B1 1-SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUND ASTELLAS PHARMA INC (JP) 2015-05-13 EP disclosed
US-8263607-B2 1-substituted tetrahydroisoquinoline compound ASTELLAS PHARMA INC. (JP) 2012-09-11 US disclosed
US-20100168154-A1 1-SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-07-01 US disclosed
EP-2149560-A1 1-SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUND Astellas Pharma Inc. (JP) 2010-02-03 EP 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-20100168154-A1 1-SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUND CACNA1S, CACNA1E, CACNA1B PRCP 3639/4885OPRM1 16/4885GAA 3366/4885

“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.