SCHEMBL6098078

SCHEMBL6098078

N#Cc1cccc2ccc(C(=O)N[C@@H]3C[C@@H]4CCN(C4)C3)cc12

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 10/20 0.55
AR P10275 5/20 0.40
GRM5 P41594 1/20 0.39
USP30 Q70CQ3 1/20 0.39
DRD4 P21917 1/20 0.39
SLC6A12 P48065 1/20 0.39
SLC6A13 Q9NSD5 1/20 0.39
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSK P43235 1/20 0.38
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
HTR3A P46098 1/20 0.38

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
SCHEMBL6098074 1.00 CHRNA7 (0.55) CHRNA7ARGRM5USP30DRD4
SCHEMBL6100438 0.95 CHRNA7 (0.48) CHRNA7ARGRM5USP30DRD4
SCHEMBL6098161 0.92 CHRNA7 (0.58) CHRNA7ARGRM5USP30DRD4
SCHEMBL6098156 0.92 CHRNA7 (0.58) CHRNA7ARGRM5USP30DRD4
SCHEMBL6098318 0.90 CHRNA7 (0.55) CHRNA7DRD4SLC6A12SLC6A13
SCHEMBL6098323 0.90 CHRNA7 (0.55) CHRNA7DRD4SLC6A12SLC6A13
SCHEMBL6098965 0.87 CHRNA7 (0.51) CHRNA7ARGRM5USP30DRD4
SCHEMBL6097374 0.84 CHRNA7 (0.48) CHRNA7DRD4SLC6A12SLC6A13HTR3A
SCHEMBL6099981 0.84 CHRNA7 (0.64) CHRNA7GRM5DRD4SLC6A12SLC6A13
SCHEMBL6099976 0.84 CHRNA7 (0.64) CHRNA7GRM5DRD4SLC6A12SLC6A13

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-7001900-B2 Azabicyclic compounds for the treatment of disease PFIZER INC. (US) 2006-02-21 US claimed
US-20030236270-A1 Azabicyclic compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
US-7001900-B2 Azabicyclic compounds for the treatment of disease PFIZER INC. (US) 2006-02-21 US disclosed
US-20030236270-A1 Azabicyclic compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 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-20030236270-A1 Azabicyclic compounds for the treatment of disease MALT1, TPMT, CYP2B6 CHRNA7 1836/4885AR 2024/4885GRM5 1965/4885

“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.