SCHEMBL2010392

SCHEMBL2010392

CCOC(=O)COC1CCN(C(=O)CNC(=O)OC(C)(C)C)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.67
TSHR P16473 2/20 0.67
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
ITGB3 P05106 4/20 0.42
ITGA2B P08514 4/20 0.42
SIGMAR1 Q99720 1/20 0.42
POLB P06746 2/20 0.36
KDM4E B2RXH2 1/20 0.36
FNTA P49354 2/20 0.35
FNTB P49356 2/20 0.35
THRB P10828 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL2010604 0.89 TSHR (0.53) ALDH1A1TSHRMEN1KMT2AITGB3
SCHEMBL8881231 0.83 MEN1 (0.50) ALDH1A1TSHRMEN1KMT2AITGB3
SCHEMBL6319049 0.81 HPGD (0.46) ITGB3ITGA2BGAAEPHX1
SCHEMBL21068423 0.80 DRD2 (0.45) ALDH1A1TSHRMEN1KMT2ASIGMAR1
SCHEMBL22859865 0.77 MEN1 (0.67) ALDH1A1TSHRMEN1KMT2ASIGMAR1
SCHEMBL15841183 0.77 ALDH1A1 (0.67) ALDH1A1TSHRMEN1KMT2ASIGMAR1
SCHEMBL1980890 0.77 PRMT5 (0.44) ALDH1A1TSHRMEN1KMT2AITGB3
SCHEMBL1975644 0.77 PRMT5 (0.44) ALDH1A1TSHRMEN1KMT2AITGB3
SCHEMBL1967730 0.77 PRMT5 (0.44) ALDH1A1TSHRMEN1KMT2AITGB3
SCHEMBL12125444 0.76 MEN1 (0.67) ALDH1A1TSHRMEN1KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964628-B2 Fibrinogen receptor antagonists and their use PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-06-21 US disclosed
US-20100256161-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-10-07 US disclosed
US-7759387-B2 Fibrinogen receptor antagonists and their use PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-07-20 US disclosed
US-20070021489-A1 Fibrinogen receptor antagonists and their use NICHOLAS PIRAMAL INDIA LIMITED (IN) 2007-01-25 US disclosed
EP-1677783-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE Nicholas Piramal India Limited (IN) 2006-07-12 EP disclosed
WO-2005035495-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE NICHOLAS PIRAMAL INDIA LIMITED (IN) 2005-04-21 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-20100256161-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE FGB, F13B, F2 ALDH1A1 2548/4885TSHR 163/4885MEN1 4472/4885
US-20070021489-A1 Fibrinogen receptor antagonists and their use FGB, F13B, F2 ALDH1A1 2548/4885TSHR 163/4885MEN1 4472/4885

“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.