SCHEMBL6920076

SCHEMBL6920076

CN(C)CCN1CCN(c2ccc(-c3nc(-c4ccccc4)c[nH]3)cn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.45
DRD4 P21917 2/20 0.44
DRD3 P35462 2/20 0.44
HTR1A P08908 1/20 0.44
HTR2A P28223 1/20 0.44
SLC6A4 P31645 1/20 0.44
AKT1 P31749 2/20 0.41
AKT2 P31751 2/20 0.41
KCNH2 Q12809 1/20 0.41
AURKA O14965 2/20 0.41
AURKB Q96GD4 2/20 0.41
FYN P06241 1/20 0.40
RAD52 P43351 2/20 0.40
KDR P35968 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
TLR9 Q9NR96 1/20 0.39
ATR Q13535 1/20 0.38
CFTR P13569 1/20 0.38
CARM1 Q86X55 1/20 0.38
DRD2 P14416 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
SCHEMBL6925387 0.86 DRD4 (0.46) RETDRD4DRD3HTR1AHTR2A
SCHEMBL6925622 0.86 HRH3 (0.45) RETDRD4DRD3HTR1AHTR2A
SCHEMBL6925451 0.84 FYN (0.54) KCNH2FYNATR
SCHEMBL6925404 0.83 AURKA (0.55) RETDRD4DRD3HTR1AHTR2A
SCHEMBL6925668 0.81 CNR2 (0.53) FYNATRKMT2A
SCHEMBL6925885 0.80 CNR2 (0.56) KMT2A
SCHEMBL6927304 0.80 DRD4 (0.59) RETDRD4DRD3HTR1AHTR2A
SCHEMBL6924723 0.79 HRH3 (0.45) RETFYNTLR7TLR9ATR
SCHEMBL6926636 0.79 TSHR (0.46) DRD4DRD3HTR1AFYNDRD2
SCHEMBL6923619 0.79 DRD3 (0.47) RETDRD4DRD3HTR1AHTR2A

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 RET 1562/4885DRD4 2672/4885DRD3 1478/4885

“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.