SCHEMBL2882809

SCHEMBL2882809

Cc1ccccc1C1CCN(C)CC1CO

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.50
KCNH2 Q12809 1/20 0.50
SIGMAR1 Q99720 3/20 0.44
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
GBA1 P04062 1/20 0.41

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
SCHEMBL10839393 1.00 OPRL1 (0.50) OPRL1KCNH2SIGMAR1HTR2AHTR2C
SCHEMBL2882813 1.00 OPRL1 (0.50) OPRL1KCNH2SIGMAR1HTR2AHTR2C
SCHEMBL2877400 0.85 SIGMAR1 (0.44) OPRL1KCNH2SIGMAR1HTR2AHTR2C
SCHEMBL27706698 0.84 SIGMAR1 (0.47) SIGMAR1HTR2CHTR2B
SCHEMBL5459468 0.80 SLC6A3 (0.54)
SCHEMBL4759732 0.80 SLC6A3 (0.54)
SCHEMBL4759736 0.80 SLC6A3 (0.54)
SCHEMBL5459465 0.80 SLC6A3 (0.54)
SCHEMBL2882981 0.80 SLC6A3 (0.54)
SCHEMBL2880558 0.80 OPRL1 (0.51) OPRL1KCNH2SIGMAR1GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7855294-B2 Cycloalkanopyridine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-21 US disclosed
US-20070191419-A1 Cycloalkanopyridine derivative MSD K.K. (JP) 2007-08-16 US disclosed
EP-1726590-A1 CYCLOALKANOPYRIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-29 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-20070191419-A1 Cycloalkanopyridine derivative OPRL1, OPRK1, AVPR2 OPRL1 1/4885KCNH2 969/4885SIGMAR1 75/4885

“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.