SCHEMBL12367663

SCHEMBL12367663

O=Cc1ccc(OC2CCN(CC3CC3)CC2)nc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.42
NAMPT P43490 2/20 0.41
HRH3 Q9Y5N1 5/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LIPE Q05469 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL23147699 0.83 ALDH1A1 (0.49) NAMPTHRH3ALDH1A1L3MBTL1KDM4E
SCHEMBL30222191 0.83 ALDH1A1 (0.49) NAMPTHRH3ALDH1A1L3MBTL1KDM4E
SCHEMBL12367667 0.82 HRH3 (0.46) NAMPTHRH3ALDH1A1L3MBTL1KDM4E
SCHEMBL2004014 0.80 HRH3 (0.58) HRH3KCNH2
SCHEMBL2893597 0.80 ALDH1A1 (0.46) NAMPTHRH3ALDH1A1L3MBTL1KDM4E
SCHEMBL12367604 0.79 OPRK1 (0.42) OPRK1NAMPTLIPEKCNH2
SCHEMBL16702162 0.79 NAMPT (0.45) NAMPTLIPE
SCHEMBL14721607 0.79 ALDH1A1 (0.45) NAMPTHRH3ALDH1A1L3MBTL1KDM4E
SCHEMBL5534680 0.79 OPRK1 (0.59) OPRK1NAMPTHRH3KCNH2
SCHEMBL15571843 0.78 HTR2A (0.38) OPRK1HRH3ALDH1A1KDM4ELIPE

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-20110207734-A1 Azine Derivatives and Methods of Use Thereof PALANI ANANDAN 2011-08-25 US disclosed
US-20110207734-A1 Azine Derivatives and Methods of Use Thereof PALANI ANANDAN 2011-08-25 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-20110207734-A1 Azine Derivatives and Methods of Use Thereof AZI2, GPR119, GID4 OPRK1 252/4885NAMPT 2261/4885HRH3 335/4885

“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.