SCHEMBL4844992

SCHEMBL4844992

CCN(CC)Cc1ccc2c(C(N)=O)cccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
GAA P10253 1/20 0.49
PARP1 P09874 6/20 0.46
HPGD P15428 2/20 0.43
HTT P42858 2/20 0.43
AOC3 Q16853 1/20 0.43
TBXAS1 P24557 1/20 0.41
MEP1B Q16820 1/20 0.40
F2 P00734 2/20 0.40
F10 P00742 2/20 0.40
F7 P08709 2/20 0.40
PARP2 Q9UGN5 2/20 0.39
PARP3 Q9Y6F1 1/20 0.39
ACHE P22303 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
AURKA O14965 2/20 0.39
MET P08581 2/20 0.39
KDR P35968 2/20 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
SCHEMBL4848291 0.86 PARP1 (0.52) KDM4EALDH1A1GAAPARP1TBXAS1
SCHEMBL4845064 0.81 AOC3 (0.41) ALDH1A1HPGDHTTAOC3ACHE
SCHEMBL4847358 0.79 KDM4E (0.57) KDM4EALDH1A1GAAPARP1TBXAS1
SCHEMBL4846719 0.78 PARP1 (0.54) KDM4EALDH1A1GAAPARP1PARP2
SCHEMBL4846986 0.77 PARP1 (0.53) KDM4EALDH1A1GAAPARP1PARP2
SCHEMBL4844999 0.75 HRH3 (0.41) AOC3
SCHEMBL8173564 0.74 MEP1B (0.66) PARP1HPGDHTTAOC3MEP1B
SCHEMBL4839401 0.73 KMT2A (0.51) KDM4EALDH1A1GAAPARP1TBXAS1
SCHEMBL10274480 0.72 KDM4E (0.61) KDM4EALDH1A1GAAPARP1HPGD
SCHEMBL634882 0.72 KDM4E (0.65) KDM4EALDH1A1GAAPARP1AURKA

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
US-7368462-B1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY (US) 2008-05-06 US claimed
US-7368462-B1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY (US) 2008-05-06 US disclosed
US-20080058423-A1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY 2008-03-06 US 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-20080058423-A1 Melanin concentrating hormone antagonists MCHR1, MCHR2, MC4R KDM4E 2926/4885ALDH1A1 3013/4885GAA 513/4885

“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.