SCHEMBL4190835

SCHEMBL4190835

CC(C)(C)OC(=O)c1ccc(CCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43
RXRA P19793 2/20 0.43
NR1H2 P55055 2/20 0.43
NR1H3 Q13133 1/20 0.43
PLA2G2A P14555 1/20 0.42
HDAC1 Q13547 7/20 0.41
HDAC6 Q9UBN7 6/20 0.41
HDAC2 Q92769 1/20 0.41
MMP1 P03956 1/20 0.40
MMP3 P08254 1/20 0.40
MMP9 P14780 1/20 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
SCHEMBL4179442 1.00 ITGB3 (0.43) ITGB3ITGA2BRXRANR1H2NR1H3
SCHEMBL4185656 0.89 SLC7A5 (0.47) PLA2G2AHDAC1HDAC6MMP1MMP3
SCHEMBL15908890 0.88 PLA2G2A (0.43) ITGB3ITGA2BPLA2G2AHDAC1HDAC6
SCHEMBL4187842 0.88 KMT2A (0.44) ITGB3ITGA2BPLA2G2AMMP1MMP3
SCHEMBL4179492 0.88 KMT2A (0.44) ITGB3ITGA2BPLA2G2AMMP1MMP3
SCHEMBL557681 0.87 HDAC1 (0.44) ITGB3ITGA2BRXRANR1H2NR1H3
SCHEMBL557604 0.85 HDAC1 (0.42) PLA2G2AHDAC1HDAC6HDAC2
SCHEMBL26091793 0.83 ITGB3 (0.46) ITGB3ITGA2BHDAC1HDAC6HDAC2
SCHEMBL26091795 0.83 ITGB3 (0.46) ITGB3ITGA2BHDAC1HDAC6HDAC2
SCHEMBL26091800 0.83 ITGB3 (0.46) ITGB3ITGA2BHDAC1HDAC6HDAC2

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-2024390-B1 INSULIN DERIVATIVE NOVO NORDISK AS (DK) 2015-08-19 EP disclosed
US-8796205-B2 Insulin derivative NOVO NORDISK A/S (DK) 2014-08-05 US disclosed
US-20090105121-A1 Insulin Derivative NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
EP-2024390-A1 INSULIN DERIVATIVE Novo Nordisk A/S (DK) 2009-02-18 EP disclosed
WO-2007128815-A1 INSULIN DERIVATIVE NOVO NORDISK A/S (DK) 2007-11-15 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-20090105121-A1 Insulin Derivative INSR, IAPP, GPR119 ITGB3 3539/4885ITGA2B 3265/4885RXRA 3670/4885

“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.