SCHEMBL6415347

SCHEMBL6415347

O=C(NC1CC2CC1CN2)c1cn2cc(Cl)cc2cn1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.35
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRM4 P08173 2/20 0.32
CHRNA7 P36544 2/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
PYGL P06737 1/20 0.31
AKT1 P31749 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL6412202 0.87 CHRNA7 (0.34) CHRNA7IRAK4AKT1
SCHEMBL6415899 0.87 IRAK4 (0.34) CHRM4IRAK4AKT1
SCHEMBL6417776 0.85 CHRNA7 (0.39) HTR3ACHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL6418481 0.85 IRAK4 (0.36) IRAK4
SCHEMBL6414371 0.85 IRAK4 (0.40) IRAK4
SCHEMBL6411707 0.84 CHRNA7 (0.37) HTR3ACHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL6411827 0.83 CHRNA7 (0.30) CHRNA7IRAK4
SCHEMBL6412154 0.82 HTR3A (0.34) HTR3ACHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL6413652 0.81 HTR3A (0.35) HTR3ACHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL6413026 0.81 CHRNA7 (0.36) CHRNB2CHRNA4CHRNB4CHRNA3CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1476449-A1 FUSED BICYCLIC-N-BRIDGED-HETEROAROMATIC CARBOXAMIDES FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-11-17 EP claimed
US-20030236264-A1 Fused bicyclic-N-bridged-heteroaromatic carboxamides for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
WO-2003070732-A1 FUSED BICYCLIC-N-BRIDGED-HETEROAROMATIC CARBOXAMIDES FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2003-08-28 WO claimed
US-20050215584-A1 Fused bicyclic-N-bridged-heteroaromatic carboxamides for the treatment of disease PFIZER INC 2005-09-29 US disclosed
US-6858613-B2 Fused bicyclic-N-bridged-heteroaromatic carboxamides for the treatment of disease PFIZER INC. (US) 2005-02-22 US disclosed
US-20030236264-A1 Fused bicyclic-N-bridged-heteroaromatic carboxamides 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 (2 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-20030236264-A1 Fused bicyclic-N-bridged-heteroaromatic carboxamides for the treatment of disease NAT1, CYP11B1, COASY HTR3A 2944/4885CHRNB2 3127/4885CHRNA4 2256/4885
US-20050215584-A1 Fused bicyclic-N-bridged-heteroaromatic carboxamides for the treatment of disease CHRNA7, UGT2B7, CHRNA5 HTR3A 788/4885CHRNB2 39/4885CHRNA4 18/4885

“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.