SCHEMBL21963797

SCHEMBL21963797

COc1ccc(CN(C)Cc2c(C)oc3c(Oc4ccc5c(c4)CCN5C(=O)O)cccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.41
NOTUM Q6P988 1/20 0.40
TP53 P04637 3/20 0.40
MAPT P10636 5/20 0.39
THRB P10828 1/20 0.39
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL30161678 0.90 LMNA (0.37) LMNANOTUMTP53MAPTTHRB
SCHEMBL22010477 0.90 LMNA (0.37) LMNANOTUMTP53MAPTTHRB
SCHEMBL31033316 0.90 LMNA (0.37) LMNANOTUMTP53MAPTTHRB
SCHEMBL21963860 0.81 KMT2A (0.44) KMT2AACHE
SCHEMBL21963920 0.77 KCNH2 (0.39) KMT2AACHE
SCHEMBL21964003 0.77 MEN1 (0.39) LMNATP53MAPTKMT2APOLB
SCHEMBL22010476 0.76 SLC6A4 (0.42) KMT2APOLBACHE
SCHEMBL22010480 0.73 GPR119 (0.37) LMNANOTUMTP53MAPT
SCHEMBL31033306 0.73 GPR119 (0.37) LMNANOTUMTP53MAPT
SCHEMBL30161412 0.73 GPR119 (0.37) LMNANOTUMTP53MAPT

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-20230035837-A1 ANTIBIOTIC COMPOUNDS, METHODS OF MANUFACTURING THE SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES THEREOF DEBIOPHARM INTERNATIONAL S.A. (CH) 2023-02-02 US disclosed
EP-3880675-A1 ANTIBIOTIC COMPOUNDS, METHODS OF MANUFACTURING THE SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES THEREOF Debiopharm International SA (CH) 2021-09-22 EP disclosed
WO-2020099341-A1 ANTIBIOTIC COMPOUNDS, METHODS OF MANUFACTURING THE SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES THEREOF DEBIOPHARM INTERNATIONAL S.A. (CH) 2020-05-22 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-20230035837-A1 ANTIBIOTIC COMPOUNDS, METHODS OF MANUFACTURING THE SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES THEREOF GMPS, GNE, GANC LMNA 1423/4885NOTUM 209/4885TP53 4481/4885

“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.