SCHEMBL6925239

SCHEMBL6925239

CC(C1CC1)N1CCN(c2cc(-c3nc(-c4ccc(F)c(Cl)c4)c[nH]3)ccn2)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 4/20 0.39
TLR8 Q9NR97 4/20 0.39
TLR7 Q9NYK1 4/20 0.39
PTPN11 Q06124 3/20 0.37
NMT1 P30419 2/20 0.36
PIK3C3 Q8NEB9 1/20 0.36
ITGB2 P05107 1/20 0.36
ICAM1 P05362 1/20 0.36
ITGAL P20701 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
TRPV3 Q8NET8 1/20 0.36
IDH1 O75874 2/20 0.36
SMG1 Q96Q15 2/20 0.35
KMO O15229 1/20 0.34
MGLL Q99685 1/20 0.34
CDK1 P06493 1/20 0.34
CDK2 P24941 1/20 0.34

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
SCHEMBL6924977 0.92 TLR9 (0.41) TLR9TLR8TLR7PIK3C3ITGB2
SCHEMBL6925647 0.91 TLR9 (0.45) TLR9TLR8TLR7PTPN11NMT1
SCHEMBL6923469 0.89 TRPV3 (0.39) TLR9TLR8TLR7PTPN11NMT1
SCHEMBL6927296 0.89 HRH3 (0.42) TLR9TLR8TLR7ITGB2ICAM1
SCHEMBL6920718 0.84 PIK3C3 (0.40) TLR9TLR8TLR7PTPN11NMT1
SCHEMBL6925663 0.83 PTPN11 (0.42) PTPN11NMT1PIK3C3KMO
SCHEMBL6922166 0.83 PIK3C3 (0.40) PTPN11NMT1PIK3C3TRPV3SMG1
SCHEMBL6926271 0.82 TLR9 (0.45) TLR9TLR8TLR7NMT1PIK3C3
SCHEMBL6925244 0.81 PIK3C3 (0.43) PTPN11PIK3C3
SCHEMBL7670770 0.80 PIK3C3 (0.43) TLR9TLR8TLR7PTPN11PIK3C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355635-B1 IMIDAZOLEBENZENE, IMIDAZOLEPYRIDINE COMPOUNDS FOR TREATMENT OF OBESITY PFIZER INC. 2002-03-12 US claimed
US-20010039277-A1 Compounds for the treatment of obesity ELLIOTT RICHARD L (US) 2001-11-08 US claimed
US-6514966-B2 Neuropeptide Y antagonists such as 2-chloro-5-(4-(3,4-dich loro-phenyl)-1H-imidazol-2-yl)-pyridine PFIZER INC. 2003-02-04 US disclosed
US-6355635-B1 IMIDAZOLEBENZENE, IMIDAZOLEPYRIDINE COMPOUNDS FOR TREATMENT OF OBESITY PFIZER INC. 2002-03-12 US disclosed
US-20010039277-A1 Compounds for the treatment of obesity ELLIOTT RICHARD L (US) 2001-11-08 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-20010039277-A1 Compounds for the treatment of obesity NPY1R, NPY4R, NPY2R TLR9 3876/4885TLR8 3260/4885TLR7 3349/4885

“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.