SCHEMBL4842706

SCHEMBL4842706

CCCCC[C@@H]1CCNC[C@@H]1C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 11/20 0.39
GNAI3 P08754 10/20 0.38
GNAI1 P63096 10/20 0.38
KCNH2 Q12809 1/20 0.34
EPHX1 P07099 1/20 0.34
ALOX5 P09917 1/20 0.33
GBA1 P04062 3/20 0.33
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL4842723 1.00 GNAO1 (0.39) GNAO1GNAI3GNAI1KCNH2EPHX1
SCHEMBL4842716 1.00 GNAO1 (0.39) GNAO1GNAI3GNAI1KCNH2EPHX1
SCHEMBL22916040 0.86 KCNH2 (0.38) GNAO1GNAI3GNAI1KCNH2NOS1
SCHEMBL14828382 0.86 KCNH2 (0.38) GNAO1GNAI3GNAI1KCNH2NOS1
SCHEMBL13483787 0.86 KCNH2 (0.38) GNAO1GNAI3GNAI1KCNH2NOS1
SCHEMBL15534390 0.86 KCNH2 (0.38) GNAO1GNAI3GNAI1KCNH2NOS1
SCHEMBL13483784 0.86 KCNH2 (0.38) GNAO1GNAI3GNAI1KCNH2NOS1
SCHEMBL23963007 0.83 GNAO1 (0.40) GNAO1GNAI3GNAI1EPHX1ALOX5
SCHEMBL3632801 0.81 KCNH2 (0.31) KCNH2
SCHEMBL5258982 0.81 CHRM2 (0.31) KCNH2

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-20080312271-A1 AZABENZIMIDAZOLYL COMPOUNDS PFIZER INC. 2008-12-18 US disclosed
WO-2008012622-A2 AZABENZIMIDAZOLYL COMPOUNDS AS POTENTIATORS OF MGLUR2 SUBTYPE OF GLUTAMATE RECEPTOR PFIZER PRODUCTS INC. (US) 2008-01-31 WO 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-20080312271-A1 AZABENZIMIDAZOLYL COMPOUNDS AZI2, PAICS, UGT2B7 GNAO1 2121/4885GNAI3 1560/4885GNAI1 1784/4885

“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.