SCHEMBL6928054

SCHEMBL6928054

CC(C)CN1CCN(c2ccc(-c3nc(-c4ccc(OC(F)(F)F)cc4)c[nH]3)cn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.41
TLR8 Q9NR97 1/20 0.41
RET P07949 4/20 0.39
MAP4K1 Q92918 1/20 0.37
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
SCN10A Q9Y5Y9 3/20 0.36
PPARD Q03181 2/20 0.35
DGAT1 O75907 2/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35
SOAT1 P35610 1/20 0.35
KCNH2 Q12809 1/20 0.35
AURKA O14965 1/20 0.35
MCHR1 Q99705 1/20 0.34
DRD2 P14416 1/20 0.34
DRD1 P21728 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
SCHEMBL6927708 0.89 TSHR (0.45) RETMAP4K1BCHEACHEBACE1
SCHEMBL6927079 0.86 TDO2 (0.43) TLR9TLR8RETAURKADRD2
SCHEMBL6920200 0.86 CHRNA7 (0.45) TLR9TLR8RETMAP4K1BCHE
SCHEMBL7667185 0.85 AURKA (0.40) RETBCHEACHEBACE1DGAT1
SCHEMBL6920570 0.84 RET (0.42) TLR9TLR8RETDGAT1KCNH2
SCHEMBL6924156 0.83 SCN9A (0.41) MAP4K1BCHEACHEBACE1SCN10A
SCHEMBL6925322 0.82 DGAT1 (0.42) BCHEACHEBACE1DGAT1KCNH2
SCHEMBL6925614 0.81 TLR8 (0.60) TLR9TLR8RETMAP4K1
SCHEMBL6923909 0.81 CNR2 (0.46) TLR9TLR8RETAURKA
SCHEMBL6926989 0.80 MGLL (0.43) TLR9TLR8RETDGAT1ABL1

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-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
WO-2000066578-A1 COMPOUNDS FOR THE TREATMENT OF OBESITY PFIZER PRODUCTS INC. (US) 2000-11-09 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-20010039277-A1 Compounds for the treatment of obesity NPY1R, NPY4R, NPY2R TLR9 3876/4885TLR8 3260/4885RET 1562/4885

“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.