SCHEMBL4772546

SCHEMBL4772546

CC(=O)NC1=CCN(Cc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.49
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
FAAH O00519 1/20 0.45
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HDAC4 P56524 1/20 0.44
CYP2D6 P10635 1/20 0.44
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 0.43

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
SCHEMBL14087069 0.82 DRD2 (0.47) NAMPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL28775447 0.81 MC4R (0.50) NAMPT
SCHEMBL9387391 0.78 CYP2D6 (0.47) NAMPTALDH1A1MEN1KMT2ATSHR
SCHEMBL22875064 0.78 SIGMAR1 (0.48) NAMPTKMT2AHDAC4OPRM1
SCHEMBL8129232 0.76 MEN1 (0.53) NAMPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL14544155 0.75 NAMPT (0.53) NAMPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL3079800 0.75 MEN1 (0.48) NAMPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL10696821 0.75 MMP2 (0.52) NAMPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL16795975 0.74 KDM4E (0.52) KDM4EALDH1A1MEN1KMT2A
SCHEMBL9074062 0.74 KDM4E (0.54) NAMPTKDM4EALDH1A1KMT2AFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1945639-A1 TETRAHYDRONAPHTHYRIDINE DERIVATIVE Pfizer Limited (GB) 2008-07-23 EP disclosed
US-20070179175-A1 Tetrahydronaphthyridine Derivative PFIZER LIMITED (GB) 2007-08-02 US disclosed
WO-2007052124-A1 TETRAHYDRONAPHTHYRIDINE DERIVATIVE PFIZER LIMITED (GB) 2007-05-10 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-20070179175-A1 Tetrahydronaphthyridine Derivative HRH4, HRH3, HRH1 NAMPT 4/4885KDM4E 2718/4885ALDH1A1 1305/4885

“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.