SCHEMBL20865641

SCHEMBL20865641

N[C@@H](Cc1ccc(O)cc1)C(=O)NCCc1ccc(O)cc1

nearest known ligand 0.84

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.64
KDM4E B2RXH2 1/20 0.60
F13A1 P00488 1/20 0.60
SLC7A5 Q01650 1/20 0.57
MMP2 P08253 1/20 0.53
NLN Q9BYT8 2/20 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
Hydrochloric Acid SCHEMBL20854816 0.98 HDAC8 (0.67) HDAC8KDM4EF13A1SLC7A5MMP2
SCHEMBL29220965 0.94 HDAC8 (0.59) HDAC8KDM4EF13A1SLC7A5
SCHEMBL28260724 0.94 HDAC8 (0.59) HDAC8KDM4EF13A1SLC7A5
SCHEMBL3806501 0.89 CA2 (0.66) HDAC8
SCHEMBL3806503 0.89 CA2 (0.66) HDAC8
SCHEMBL7559848 0.89 HDAC8 (0.64) HDAC8KDM4ESLC7A5
SCHEMBL24276974 0.87 HDAC8 (0.57) HDAC8KDM4EF13A1NLN
SCHEMBL7377691 0.87 SLC7A5 (0.57) HDAC8SLC7A5MMP2
Hydrochloric Acid SCHEMBL6299983 0.87 SLC7A5 (0.57) HDAC8SLC7A5MMP2
SCHEMBL24276971 0.87 HDAC8 (0.57) HDAC8KDM4EF13A1NLN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10781166-B2 Biocompositions for 3D printing 3D-BIOMATERIALS, LLC (US) 2020-09-22 US disclosed
US-20190194123-A1 BIOCOMPOSITIONS FOR 3D PRINTING 3D - BIOMATERIALS, LLC 2019-06-27 US disclosed
WO-2019067599-A1 BIOCOMPOSITIONS FOR 3D PRINTING NOVOSET, LLC (US) 2019-04-04 WO disclosed
US-20190100489-A1 BIOCOMPOSITIONS FOR 3D PRINTING 3D - BIOMATERIALS, LLC 2019-04-04 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 (3 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-20190194123-A1 BIOCOMPOSITIONS FOR 3D PRINTING HTR3D, ILK, ITGB3 HDAC8 4056/4885KDM4E 2486/4885F13A1 281/4885
US-20190100489-A1 BIOCOMPOSITIONS FOR 3D PRINTING HTR3D, ILK, ITGB3 HDAC8 4056/4885KDM4E 2486/4885F13A1 281/4885
US-10781166-B2 Biocompositions for 3D printing HTR3D, ILK, ITGB3 HDAC8 4056/4885KDM4E 2486/4885F13A1 281/4885

“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.