SCHEMBL21553770

SCHEMBL21553770

COCCN(Cc1cc(O)cc(-c2cc(Cl)cc(Cl)c2)c1)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.35
HDAC3 O15379 2/20 0.35
HDAC2 Q92769 2/20 0.35
NCOR2 Q9Y618 2/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CRHR1 P34998 2/20 0.32
SSTR4 P31391 1/20 0.31
CNR2 P34972 3/20 0.31
MLYCD O95822 1/20 0.31
APP P05067 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL30931859 1.00 HDAC1 (0.35) HDAC1HDAC3HDAC2NCOR2MEN1
SCHEMBL21551743 0.85 MEN1 (0.40) HDAC1MEN1KMT2ASMN1; SMN2CRHR1
SCHEMBL30931825 0.81 HTR2C (0.38) CNR2APP
SCHEMBL29890838 0.81 HTR2C (0.38) CNR2APP
SCHEMBL17513219 0.72 CA14 (0.36) HDAC1HDAC3HDAC2NCOR2SSTR4
SCHEMBL17513259 0.72 L3MBTL1 (0.40) HDAC1HDAC3HDAC2NCOR2SSTR4
SCHEMBL3567836 0.72 RIPK1 (0.46) HDAC1HDAC3HDAC2NCOR2MEN1
SCHEMBL89599 0.72 GRIN2D (0.40) HDAC1HDAC3HDAC2NCOR2SSTR4
SCHEMBL17533842 0.72 FFAR4 (0.36) HDAC1HDAC3HDAC2NCOR2SSTR4
SCHEMBL89601 0.71 GRIN2D (0.39) HDAC1HDAC3HDAC2NCOR2SSTR4

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-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 EP disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-20220315556-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-10-06 US disclosed
EP-3790871-A1 FURIN INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2021-03-17 EP disclosed
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 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 (2 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-20220315556-A1 FURIN INHIBITORS FURIN, TGFB1, PCSK7 HDAC1 959/4885HDAC3 2069/4885HDAC2 2399/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 HDAC1 959/4885HDAC3 2069/4885HDAC2 2399/4885

“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.