SCHEMBL4996799

SCHEMBL4996799

Cc1ccc(C(C)NC(=O)C(N)=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
ALOX5 P09917 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 3/20 0.44
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 1/20 0.41
ALOX12 P18054 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HPGD P15428 1/20 0.41
PHGDH O43175 1/20 0.41
MMP9 P14780 1/20 0.41
GPR139 Q6DWJ6 2/20 0.40

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
SCHEMBL29261487 0.85 LMNA (0.61) LMNAALOX5L3MBTL1ALDH1A1TAS1R3
SCHEMBL13528632 0.84 SMN1; SMN2 (0.57) LMNAALOX5ALDH1A1HPGD
SCHEMBL10315770 0.83 L3MBTL1 (0.45) LMNAALOX5L3MBTL1ALDH1A1TAS1R3
SCHEMBL20791688 0.80 L3MBTL1 (0.53) LMNAL3MBTL1ALDH1A1TAS1R3TAS1R1
SCHEMBL20791689 0.80 L3MBTL1 (0.53) LMNAL3MBTL1ALDH1A1TAS1R3TAS1R1
SCHEMBL2655264 0.79 ACACB (0.54)
SCHEMBL7723690 0.79 ACACB (0.54)
SCHEMBL7361907 0.77 TDP1 (0.46) LMNAALDH1A1TDP1MAPTALOX12
SCHEMBL31558936 0.77 PDE2A (0.50) LMNAALDH1A1
SCHEMBL14521516 0.77 ACACB (0.49) LMNAL3MBTL1TAS1R3TAS1R1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080166359-A1 Methods of using MEK inhibitors EXELIXIS, INC. 2008-07-10 US claimed

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-20080166359-A1 Methods of using MEK inhibitors BRAF, NRAS, KRAS LMNA 3235/4885ALOX5 1753/4885L3MBTL1 3691/4885

“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.