SCHEMBL5466976

SCHEMBL5466976

[CH](CN1CCCCC1)N1CCCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HRH3 Q9Y5N1 2/20 0.38
MAPT P10636 2/20 0.37
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
LTA4H P09960 1/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT8 Q9NR22 1/20 0.33
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL5233749 1.00 CHRNB2 (0.41) CHRNB2CHRNB4CHRNA3CHRNA4HSD17B10
SCHEMBL5721027 0.84 HRH3 (0.39) HSD17B10SMN1; SMN2HRH3ALDH1A1MEN1
SCHEMBL2031634 0.84 CXCR4 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL6780002 0.80 MC4R (0.36) MAPTGAACARM1PRMT6PRMT8
SCHEMBL5454740 0.80 HRH3 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4HSD17B10
SCHEMBL140227 0.74
SCHEMBL20919462 0.74 HSD17B10 (0.45) CHRNB2CHRNB4CHRNA3CHRNA4HSD17B10
SCHEMBL45553 0.74 LTA4H (0.39) CHRNB2CHRNB4CHRNA3CHRNA4HSD17B10
SCHEMBL1720282 0.74 HRH3 (0.46) HSD17B10SMN1; SMN2HRH3MAPTALDH1A1
SCHEMBL23872301 0.73 HRH3 (0.43) CHRNB2CHRNB4CHRNA3CHRNA4HSD17B10

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-20070043010-A1 Quinazoline derivatives ASTRAZENECA UK LIMITED (GB) 2007-02-22 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-20070043010-A1 Quinazoline derivatives ERBB2, ABL1, EGFR CHRNB2 3715/4885CHRNB4 3777/4885CHRNA3 2672/4885

“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.