SCHEMBL5763372

SCHEMBL5763372

COC(=O)c1ccc(C2CN(C(=O)OC(C)(C)C)CCN2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PDE4B Q07343 2/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 3/20 0.41
PKM P14618 1/20 0.41
USP30 Q70CQ3 1/20 0.40
GPR119 Q8TDV5 3/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 2/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL31248558 1.00 NR1H2 (0.43) NR1H2HDAC1HDAC6PDE4BMAPK1
SCHEMBL30988665 1.00 NR1H2 (0.43) NR1H2HDAC1HDAC6PDE4BMAPK1
SCHEMBL31248547 1.00 NR1H2 (0.43) NR1H2HDAC1HDAC6PDE4BMAPK1
SCHEMBL31248557 0.87 PDE4B (0.40) NR1H2PDE4BMAPK1KMT2APKM
SCHEMBL12520694 0.87 ALDH1A1 (0.51) PDE4BMAPK1KMT2AGPR119MAPT
SCHEMBL6017253 0.86 GPR119 (0.49) PDE4BMAPK1KMT2AGPR119TP53
SCHEMBL26102356 0.86 GPR119 (0.49) PDE4BMAPK1KMT2AGPR119TP53
SCHEMBL16026535 0.86 ESR2 (0.44) PDE4BMAPK1KMT2AUSP30GPR119
SCHEMBL17519223 0.85 RORC (0.44) HDAC1PDE4BMAPK1KMT2AGPR119
SCHEMBL38661093 0.85 MAPK1 (0.45) PDE4BMAPK1USP30GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4739667-A2 INDOLE DERIVATIVES WITH FACTOR B INHIBITORY ACTIVITY Sitala Bio Ltd (GB) 2026-05-13 EP disclosed
CN-119330893-A Resolution method of nitrogen heterocyclic derivative 南京正大天晴制药有限公司 2025-01-21 CN disclosed
WO-2025008516-A2 NOVEL COMPOUNDS SITALA BIO LTD (GB) 2025-01-09 WO disclosed
EP-1358183-B1 CYSTEINE PROTEASE INHIBITORS MEDIVIR AB (SE) 2006-04-12 EP disclosed
US-20050070598-A1 Cysteine protease inhibitors MEDIVIR AB (SE) 2005-03-31 US disclosed
US-20040229915-A1 Cysteine protease inhibitors MEDIVIR AB (SE) 2004-11-18 US disclosed
EP-1358183-A2 CYSTEINE PROTEASE INHIBITORS MEDIVIR AB (SE) 2003-11-05 EP disclosed
US-20030186962-A1 Cysteine protease inhibitors MEDIVIR AB (SE) 2003-10-02 US disclosed
WO-2002088106-A2 CYSTEINE PROTEASE INHIBITORS MEDIVIR AB (SE) 2002-11-07 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 (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-20030186962-A1 Cysteine protease inhibitors C1R, CTSS, CTSZ NR1H2 860/4885HDAC1 493/4885HDAC6 215/4885
US-20050070598-A1 Cysteine protease inhibitors CTRL, CTSZ, CTSS NR1H2 1544/4885HDAC1 524/4885HDAC6 162/4885
US-20040229915-A1 Cysteine protease inhibitors C1R, CTRL, CTSK NR1H2 937/4885HDAC1 343/4885HDAC6 291/4885

“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.