SCHEMBL1722472

SCHEMBL1722472

O=C(c1ccc(NCc2ccccc2)cc1)N1CCc2ccccc2C1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.65
HPGD P15428 8/20 0.63
HTT P42858 2/20 0.63
CYP3A4 P08684 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C19 P33261 1/20 0.60
LMNA P02545 3/20 0.58
SLC6A7 Q99884 1/20 0.58
ALDH1A1 P00352 3/20 0.57
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
MAPT P10636 2/20 0.54
KMT2A Q03164 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
NPC1 O15118 1/20 0.51

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
SCHEMBL30277860 0.81 HPGD (0.73) NAMPTHPGDHTTCYP3A4CYP2D6
SCHEMBL4279383 0.81 HPGD (0.73) NAMPTHPGDHTTCYP3A4CYP2D6
SCHEMBL20394942 0.81 SLC6A7 (0.68) NAMPTHPGDHTTCYP2D6CYP2C19
SCHEMBL1711101 0.80 SLC6A7 (0.67) NAMPTHPGDLMNASLC6A7ALDH1A1
SCHEMBL3704448 0.79 NAMPT (1.00) NAMPTALDH1A1KMT2ARAB9ASMN1; SMN2
SCHEMBL20389221 0.78 NAMPT (1.00) NAMPTHTT
SCHEMBL8429770 0.78 HPGD (0.71) NAMPTHPGDHTTCYP3A4CYP2D6
SCHEMBL28056725 0.78 HPGD (0.60) NAMPTHPGDCYP3A4CYP2D6CYP2C19
SCHEMBL3278646 0.77 SLC6A7 (0.74) HTTLMNASLC6A7ALDH1A1CA1
SCHEMBL2639196 0.77 HSD17B3 (0.68) MAPTKMT2ATDP1RAB9ASMN1; SMN2

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
EP-2344456-B1 NOVEL POTASSIUM CHANNEL BLOCKER JAPAN TOBACCO INC (JP) 2018-07-25 EP disclosed
US-8258138-B2 Potassium channel blockers XENTION LIMITED (GB) 2012-09-04 US disclosed
EP-2344456-A1 NOVEL POTASSIUM CHANNEL BLOCKER Xention Limited (GB) 2011-07-20 EP disclosed
US-20100087437-A1 Novel Potassium Channel Blockers XENTION LIMITED (GB) 2010-04-08 US disclosed
WO-2010023445-A1 NOVEL POTASSIUM CHANNEL BLOCKER XENTION LIMITED (GB) 2010-03-04 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-20100087437-A1 Novel Potassium Channel Blockers KCNB1, KCNJ2, KCNJ11 NAMPT 2705/4885HPGD 3739/4885HTT 3548/4885

“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.