SCHEMBL7607972

SCHEMBL7607972

O=C(N[C@H]1CN2CCC1CC2)c1ccc(Sc2ccc([AsH2])cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 10/20 0.80
HTR3A P46098 6/20 0.64
HTR3E A5X5Y0 5/20 0.64
HTR3B O95264 5/20 0.64
HTR3D Q70Z44 5/20 0.64
HTR3C Q8WXA8 5/20 0.64
ALOX15 P16050 1/20 0.64
TSHR P16473 1/20 0.64
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ATM Q13315 1/20 0.53
CHRNB4 P30926 2/20 0.52
CHRNA3 P32297 2/20 0.52
CYP2D6 P10635 1/20 0.52

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
SCHEMBL373736 0.89 CHRNA7 (1.00) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL6881216 0.89 CHRNA7 (0.81) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL834016 0.89 CHRNA7 (1.00) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL6873009 0.88 CHRNA7 (0.80) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL6881399 0.88 CHRNA7 (0.80) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL6882647 0.88 CHRNA7 (0.80) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL372855 0.88 CHRNA7 (0.85) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL13496959 0.85 CHRNA7 (0.76) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL6883592 0.84 CHRNA7 (0.74) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL6883132 0.84 CHRNA7 (0.74) CHRNA7HTR3AHTR3EHTR3BHTR3D

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-20020052389-A1 Treating a disease or condition in a mammal, wherein the alpha 7 nicotinic-acetylcholine receptor is implicated PHARMACIA & UPJOHN COMPANY 2002-05-02 US claimed

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-20020052389-A1 Treating a disease or condition in a mammal, wherein the alpha 7 nicotinic-acetylcholine receptor is implicated CHRNA7, CHRNA1, CHRNB1 CHRNA7 1/4885HTR3A 882/4885HTR3E 2024/4885

“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.