SCHEMBL1357965

SCHEMBL1357965

COc1cc(COC(=O)N2C(C)CCCC2C)c([N+](=O)[O-])c(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
POLB P06746 2/20 0.46
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 2/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
HPGD P15428 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
SCHEMBL13298530 0.85 POLB (0.46) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL1358578 0.83 ALDH1A1 (0.51) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL1357412 0.81 ALDH1A1 (0.53) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL1357399 0.81 ALDH1A1 (0.48) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL1358024 0.80 ALDH1A1 (0.52) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL7737475 0.79 L3MBTL1 (0.44) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL15966114 0.79 ALDH1A1 (0.51) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL10360681 0.74 ALDH1A1 (0.45) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL17763408 0.74 ALDH1A1 (0.45) ALDH1A1POLBKMT2AMEN1HPGD
SCHEMBL14962142 0.73 ALDH1A1 (0.44) ALDH1A1POLBKMT2AMEN1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859186-B2 Polyimide precursor, resin composition comprising the polyimide precursor, pattern forming method using the resin composition, and articles produced by using the resin composition DAI NIPPON PRINTING CO., LTD. (JP) 2014-10-14 US disclosed
US-20110281218-A1 POLYIMIDE PRECURSOR, RESIN COMPOSITION COMPRISING THE POLYIMIDE PRECURSOR, PATTERN FORMING METHOD USING THE RESIN COMPOSITION, AND ARTICLES PRODUCED BY USING THE RESIN COMPOSITION DAI NIPPON PRINTING CO., LTD. (JP) 2011-11-17 US disclosed
US-20090263745-A1 POLYIMIDE PRECURSOR, RESIN COMPOSITION COMPRISING THE POLYIMIDE PRECURSOR, PATTERN FORMING METHOD USING THE RESIN COMPOSITION, AND ARTICLES PRODUCED BY USING THE RESIN COMPOSITION DAI NIPPON PRINTING CO., LTD. (JP) 2009-10-22 US 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-20090263745-A1 POLYIMIDE PRECURSOR, RESIN COMPOSITION COMPRISING THE POLYIMIDE PRECURSOR, PATTERN FORMING METHOD USING THE RESIN COMPOSITION, AND ARTICLES PRODUCED BY USING THE RESIN COMPOSITION TERB1, PUF60, CD79B ALDH1A1 2911/4885POLB 647/4885KMT2A 826/4885

“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.