SCHEMBL6486376

SCHEMBL6486376

Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CCN(C3)C2)o1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
CHRNA7 P36544 8/20 0.56
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
TSHR P16473 1/20 0.43
CHRNB2 P17787 2/20 0.43
CHRNA4 P43681 2/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
KLK7 P49862 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL6486371 1.00 HPGD (0.59) HPGDSMN1; SMN2CHRNA7ALDH1A1HSD17B10
SCHEMBL6497255 0.85 CHRNA7 (0.63) HPGDSMN1; SMN2CHRNA7ALDH1A1TSHR
SCHEMBL6497249 0.85 CHRNA7 (0.63) HPGDSMN1; SMN2CHRNA7ALDH1A1TSHR
SCHEMBL6488541 0.85 HPGD (0.60) HPGDSMN1; SMN2CHRNA7ALDH1A1TSHR
SCHEMBL6488534 0.85 HPGD (0.60) HPGDSMN1; SMN2CHRNA7ALDH1A1TSHR
SCHEMBL6487314 0.83 CHRNA7 (0.50) HPGDSMN1; SMN2CHRNA7ALDH1A1HSD17B10
SCHEMBL6487322 0.83 CHRNA7 (0.50) HPGDSMN1; SMN2CHRNA7ALDH1A1HSD17B10
SCHEMBL6497048 0.82 ALDH1A1 (0.51) HPGDSMN1; SMN2CHRNA7ALDH1A1
SCHEMBL6497050 0.82 ALDH1A1 (0.51) HPGDSMN1; SMN2CHRNA7ALDH1A1
SCHEMBL6487632 0.81 CHRNA7 (0.52) HPGDSMN1; SMN2CHRNA7ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US claimed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 US claimed
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US disclosed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 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-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease MALT1, WFS1, NR5A1 HPGD 706/4885SMN1; SMN2 1751/4885CHRNA7 1097/4885

“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.