SCHEMBL2734818

SCHEMBL2734818

CCCCOC(=O)[C@H](CC)NP(=O)(COCCn1cnc2c(NC3CC3)nc(N)nc21)Oc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
PDGFRA P16234 7/20 0.39
CCNE1 P24864 7/20 0.39
CDK2 P24941 7/20 0.39
HDAC1 Q13547 1/20 0.39
SERPINA3 P01011 1/20 0.37
ABCB1 P08183 5/20 0.37
FGFR1 P11362 2/20 0.36

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
SCHEMBL2734808 1.00 POLB (0.54) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2734821 0.98 POLB (0.54) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2734823 0.94 POLB (0.52) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2734816 0.94 POLB (0.56) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2734813 0.93 POLB (0.55) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2759922 0.92 POLB (0.58) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2734817 0.91 POLB (0.54) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2734815 0.91 POLB (0.54) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2734672 0.89 POLB (0.62) POLBPDGFRACCNE1CDK2HDAC1
SCHEMBL2734679 0.89 POLB (0.56) POLBPDGFRACCNE1CDK2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268802-B2 Anti-proliferative compounds, compositions, and methods of use thereof GILEAD SCIENCES, INC. (US) 2012-09-18 US disclosed
US-8088754-B2 Anti-proliferative compounds, compositions, and methods of use thereof GILEAD SCIENCES, INC. (US) 2012-01-03 US disclosed
US-20090291922-A1 ANTI-PROLIFERATIVE COMPOUNDS, COMPOSITIONS, AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. (US) 2009-11-26 US disclosed
US-7553825-B2 Anti-proliferative compounds, compositions, and methods of use thereof GILEAD SCIENCES, INC. (US) 2009-06-30 US disclosed
US-20090149400-A1 ANTI-PROLIFERATIVE COMPOUNDS, COMPOSITIONS, AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. (US) 2009-06-11 US disclosed
WO-2007002808-A1 ANTI-NONMELANOMA CARCINOMA COMPOUNDS, COMPOSITIONS, AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. (US) 2007-01-04 WO disclosed
WO-2007002912-A2 ANTI-PROLIFERATIVE COMPOUNDS, COMPOSITIONS, AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. (US) 2007-01-04 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-20090149400-A1 ANTI-PROLIFERATIVE COMPOUNDS, COMPOSITIONS, AND METHODS OF USE THEREOF CCNY, CCNO, CCNB3 POLB 82/4885PDGFRA 2906/4885CCNE1 40/4885
US-20090291922-A1 ANTI-PROLIFERATIVE COMPOUNDS, COMPOSITIONS, AND METHODS OF USE THEREOF CCNY, CCNO, CCNB3 POLB 82/4885PDGFRA 2906/4885CCNE1 40/4885

“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.