SCHEMBL14435006

SCHEMBL14435006

NOOSc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc3ccccc3c1)N2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.46
MAPT P10636 3/20 0.46
GAA P10253 1/20 0.46
USP7 Q93009 2/20 0.45
CYBB P04839 1/20 0.45
AR P10275 5/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
KLK3 P07288 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
MCL1 Q07820 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL14435011 1.00 CHRNA7 (0.46) CHRNA7MAPTGAAUSP7CYBB
SCHEMBL14435013 0.86 MAPT (0.49) CHRNA7MAPTGAAUSP7AR
SCHEMBL14435016 0.86 MAPT (0.49) CHRNA7MAPTGAAUSP7AR
SCHEMBL14435015 0.86 MAPT (0.49) CHRNA7MAPTGAAUSP7AR
SCHEMBL14435014 0.86 MAPT (0.49) CHRNA7MAPTGAAUSP7AR
SCHEMBL5521706 0.79 MAPT (0.54) CHRNA7MAPTGAAUSP7CYBB
SCHEMBL5522483 0.79 MAPT (0.54) CHRNA7MAPTGAAUSP7CYBB
SCHEMBL5516230 0.76 CHRNA7 (0.76) CHRNA7MAPTGAAUSP7CYBB
SCHEMBL5522476 0.76 CHRNA7 (0.76) CHRNA7MAPTGAAUSP7CYBB
SCHEMBL5523607 0.76 CHRNA7 (0.76) CHRNA7MAPTGAAUSP7CYBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070179172-A1 Positive modulators of nicotinic acetylcholine receptors ASTRAZENECA AB (SE) 2007-08-02 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-20070179172-A1 Positive modulators of nicotinic acetylcholine receptors CHRNA1, CHRNA2, CHRM1 CHRNA7 10/4885MAPT 1307/4885GAA 2936/4885

“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.