SCHEMBL2010417

SCHEMBL2010417

CCOC(=O)COc1ccccc1OCC(=O)OCC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.67
ABCB1 P08183 1/20 0.61
GLA P06280 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
ALDH1A1 P00352 4/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
LMNA P02545 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
PTPN1 P18031 1/20 0.60
NPC1 O15118 1/20 0.60
S1PR4 O95977 1/20 0.60
MAPT P10636 1/20 0.60
ITGA4 P13612 1/20 0.60
HPGD P15428 1/20 0.60
S1PR1 P21453 1/20 0.60
MAPK1 P28482 1/20 0.60
RAB9A P51151 1/20 0.60
TLR9 Q9NR96 1/20 0.60
CASP3 P42574 1/20 0.57
CASP7 P55210 1/20 0.57

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
SCHEMBL11825493 0.96 GLA (0.68) USP2ABCB1GLAL3MBTL1ALDH1A1
SCHEMBL5318188 0.93 SMN1; SMN2 (0.64) USP2ABCB1GLAL3MBTL1ALDH1A1
Ethyl Bromo Acetate SCHEMBL5783532 0.91 USP2 (0.58) USP2ABCB1GLAL3MBTL1ALDH1A1
SCHEMBL2871937 0.91 MAPT (0.62) USP2ABCB1ALDH1A1SMN1; SMN2LMNA
SCHEMBL9369313 0.90 USP2 (0.57) USP2ABCB1GLAL3MBTL1ALDH1A1
SCHEMBL30717645 0.90 USP2 (0.61) USP2ABCB1GLAL3MBTL1ALDH1A1
SCHEMBL3154126 0.89 L3MBTL1 (0.62) USP2ABCB1GLAL3MBTL1ALDH1A1
SCHEMBL3259595 0.89 USP2 (0.60) USP2ABCB1GLAL3MBTL1ALDH1A1
SCHEMBL2011265 0.88 USP2 (0.58) USP2ABCB1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL257483 0.88 USP2 (0.58) USP2ABCB1L3MBTL1ALDH1A1SMN1; SMN2

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
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
CN-1678321-A Methods of treating or preventing autoimmune diseases with 2, 4-pyrimidinediamine compounds RIGEL PHARMACEUTICALS INC (US) 2005-10-05 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 (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 USP2 4581/4885ABCB1 568/4885GLA 1865/4885
US-20070021489-A1 Fibrinogen receptor antagonists and their use FGB, F13B, F2 USP2 4581/4885ABCB1 568/4885GLA 1865/4885

“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.