SCHEMBL2883808

SCHEMBL2883808

CC1(C)OC2(CCN(C[C@@H]3Cc4cccnc4[C@@H](O)C3)CC2)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 14/20 0.56
KCNH2 Q12809 11/20 0.55
AVPR1A P37288 3/20 0.40

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
SCHEMBL2885099 0.84 OPRL1 (0.56) OPRL1KCNH2
SCHEMBL12975867 0.80 AVPR1A (0.40) OPRL1KCNH2AVPR1A
SCHEMBL12975861 0.80 OPRL1 (0.47) OPRL1KCNH2AVPR1A
SCHEMBL2881198 0.78 OPRL1 (0.55) OPRL1KCNH2
SCHEMBL2880921 0.77 OPRL1 (0.46) OPRL1KCNH2
SCHEMBL2882469 0.72 OPRL1 (0.43) OPRL1KCNH2
SCHEMBL2877576 0.70 OPRL1 (0.66) OPRL1KCNH2
SCHEMBL10819385 0.67 AVPR1A (0.47) AVPR1A
SCHEMBL6504782 0.67 OPRL1 (0.67) OPRL1KCNH2AVPR1A
SCHEMBL6504786 0.67 OPRL1 (0.67) OPRL1KCNH2AVPR1A

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 7 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-7855294-B2 Cycloalkanopyridine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-21 US disclosed
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
US-20070191419-A1 Cycloalkanopyridine derivative MSD K.K. (JP) 2007-08-16 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 969/4885AVPR1A 7/4885

“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.