SCHEMBL6923619

SCHEMBL6923619

CCCN1CCN(c2ccc(-c3nc(-c4ccc(F)cc4)c[nH]3)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 7/20 0.47
HTR2A P28223 6/20 0.47
DRD4 P21917 5/20 0.47
HTR1A P08908 4/20 0.47
SLC6A4 P31645 2/20 0.47
TDO2 P48775 3/20 0.46
DRD2 P14416 8/20 0.45
DRD1 P21728 3/20 0.45
DRD5 P21918 3/20 0.45
HTR2C P28335 3/20 0.45
HTR7 P34969 3/20 0.45
AURKA O14965 1/20 0.44
AURKB Q96GD4 1/20 0.44
TMEM97 Q5BJF2 3/20 0.43
SIGMAR1 Q99720 3/20 0.43
RET P07949 3/20 0.42
HDAC10 Q969S8 1/20 0.39
ALK Q9UM73 1/20 0.39

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
SCHEMBL6925946 0.91 TDO2 (0.45) DRD3HTR2ADRD4HTR1ASLC6A4
SCHEMBL6925583 0.89 HTR2A (0.47) DRD3HTR2ADRD4HTR1ASLC6A4
SCHEMBL6927588 0.89 DRD3 (0.47) DRD3HTR2ADRD4HTR1ASLC6A4
SCHEMBL6926756 0.88 TDO2 (0.58) DRD3HTR2ADRD4HTR1ASLC6A4
SCHEMBL6925249 0.86 ITGB2 (0.49) DRD3HTR2ADRD4HTR1ASLC6A4
SCHEMBL6927079 0.86 TDO2 (0.43) DRD3HTR2ADRD4HTR1ASLC6A4
SCHEMBL6927304 0.85 DRD4 (0.59) DRD3HTR2ADRD4HTR1ASLC6A4
SCHEMBL6924750 0.85 CNR2 (0.46) TDO2AURKAAURKBSIGMAR1RET
SCHEMBL6924961 0.84 DRD4 (0.42) DRD3HTR2ADRD4HTR1ASLC6A4
SCHEMBL6925111 0.83 TDO2 (0.43) DRD3HTR2ADRD4HTR1ASLC6A4

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 DRD3 1478/4885HTR2A 169/4885DRD4 2672/4885

“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.