SCHEMBL6099407

SCHEMBL6099407

O=C(N[C@@H]1C[C@H]2CCN(C2)C1)c1ccccn1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 7/20 0.61
GRM5 P41594 8/20 0.61
SMYD3 Q9H7B4 1/20 0.52
KDM4E B2RXH2 1/20 0.51
GAA P10253 1/20 0.51
KMT2A Q03164 1/20 0.51
CRBN Q96SW2 1/20 0.48
KDM5A P29375 1/20 0.47
USP30 Q70CQ3 1/20 0.45

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
SCHEMBL6099413 1.00 CHRNA7 (0.61) CHRNA7GRM5SMYD3KDM4EGAA
SCHEMBL6102229 0.94 GRM5 (0.63) CHRNA7GRM5SMYD3KDM4EGAA
SCHEMBL6100893 0.84 CHRNA7 (0.58) CHRNA7GRM5KMT2AKDM5AUSP30
SCHEMBL6100887 0.84 CHRNA7 (0.58) CHRNA7GRM5KMT2AKDM5AUSP30
SCHEMBL6098248 0.81 CHRNA7 (0.69) CHRNA7USP30
SCHEMBL6098256 0.81 CHRNA7 (0.69) CHRNA7USP30
SCHEMBL4795803 0.80 CHRNA7 (0.75) CHRNA7KMT2A
SCHEMBL6100979 0.79 CHRNA7 (0.59) CHRNA7GRM5SMYD3USP30
SCHEMBL6101110 0.79 CHRNA7 (0.61) CHRNA7GRM5SMYD3USP30
SCHEMBL6101120 0.79 CHRNA7 (0.61) CHRNA7GRM5SMYD3USP30

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 8 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
EP-1478646-A1 AZABICYCLIC COMPOUNDS WITH ALFA7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP claimed
US-20030236270-A1 Azabicyclic compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
WO-2003072578-A1 AZABICYCLIC COMPOUNDS WITH ALFA7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 WO claimed
US-7001900-B2 Azabicyclic compounds for the treatment of disease PFIZER INC. (US) 2006-02-21 US disclosed
EP-1478646-A1 AZABICYCLIC COMPOUNDS WITH ALFA7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP disclosed
US-20030236270-A1 Azabicyclic compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US disclosed
WO-2003072578-A1 AZABICYCLIC COMPOUNDS WITH ALFA7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 WO 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 1836/4885GRM5 1965/4885SMYD3 2213/4885

“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.