SCHEMBL21564366

SCHEMBL21564366

COC(=O)CC1(N)CCNCC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 1/20 0.39
TSHR P16473 4/20 0.34
OPRM1 P35372 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
LMNA P02545 1/20 0.31
CYP1A2 P05177 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
SCHEMBL370386 0.86
Hydrochloric Acid SCHEMBL15610727 0.84 TSHR (0.40) KDM4EKMT2ATP53TSHRHSD17B10
SCHEMBL21551448 0.83 OPRM1 (0.43) KDM4EKMT2AOPRM1MGAMGAA
SCHEMBL3737098 0.82 TSHR (0.39) KDM4ETP53TSHRHSD17B10MGAM
SCHEMBL15621351 0.82 TSHR (0.39) KDM4ETP53TSHRHSD17B10MGAM
SCHEMBL2311427 0.80 TSHR (0.39) KDM4ETP53TSHRHSD17B10MGAM
Hydrochloric Acid SCHEMBL3709400 0.78 TSHR (0.38) KDM4EKMT2ATP53TSHRHSD17B10
SCHEMBL14173377 0.78 TSHR (0.41) KDM4EKMT2ATP53TSHROPRM1
SCHEMBL14173382 0.78 TP53 (0.40) KDM4EKMT2ATP53TSHROPRM1
SCHEMBL5510562 0.78 TP53 (0.36) KDM4ETP53TSHRHSD17B10MGAM

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-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 WO disclosed
CN-1420881-A Beta-amino acid derivs. as inhibitors of matrix metalloproteases and TNF-alpha BRISTOL MYERS SQUIBB PHARMACEU (US) 2003-05-28 CN 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-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 KDM4E 4275/4885KMT2A 4129/4885TP53 1564/4885

“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.