SCHEMBL1523071

SCHEMBL1523071

CCOC(=O)c1c(O)c2c(Cl)cccc2n(CCC(C)C)c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.52
LMNA P02545 3/20 0.52
ALDH1A1 P00352 8/20 0.51
HTT P42858 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
NPSR1 Q6W5P4 2/20 0.44
POLB P06746 1/20 0.43
PABPC1 P11940 1/20 0.43
RECQL P46063 1/20 0.43
HPGD P15428 3/20 0.41
USP2 O75604 1/20 0.41
MAPT P10636 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40

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
SCHEMBL28036699 0.87 KDM4E (0.66) KDM4ELMNAALDH1A1HTTL3MBTL1
SCHEMBL6514641 0.85 MEN1 (0.43) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL1685962 0.83 ALDH1A1 (0.65) KDM4ELMNAALDH1A1HTTL3MBTL1
SCHEMBL12009978 0.79 ALDH1A1 (0.56) KDM4ELMNAALDH1A1HTTL3MBTL1
SCHEMBL24054706 0.76 KDM4E (0.52) KDM4ELMNAALDH1A1HTTL3MBTL1
SCHEMBL10044899 0.74 ALDH1A1 (0.53) KDM4ELMNAALDH1A1HTTL3MBTL1
SCHEMBL15936261 0.73 MEN1 (0.51) KDM4ELMNAALDH1A1HTTL3MBTL1
SCHEMBL16102514 0.73 MEN1 (0.39) KDM4ELMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL10044903 0.73 ALDH1A1 (0.51) KDM4ELMNAALDH1A1HTTL3MBTL1
SCHEMBL3761069 0.73 ALDH1A1 (0.51) KDM4ELMNAALDH1A1HTTL3MBTL1

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-2361913-A1 Anti-infective agents Abbott Laboratories (US) 2011-08-31 EP disclosed
US-7902203-B2 Anti-infective agents ABBOTT LABORATORIES, INC. (US) 2011-03-08 US disclosed
EP-1560827-B1 ANTI-INFECTIVE AGENTS ABBOTT LAB (US) 2010-12-29 EP disclosed
CN-100376572-C Anti-infective agents ABBOTT LAB (US) 2008-03-26 CN disclosed
CN-1735612-A Anti-infective agents ABBOTT LAB (US) 2006-02-15 CN disclosed
US-20040167123-A1 Anti-infective agents ABBVIE INC. 2004-08-26 US disclosed
US-20040162285-A1 Anti-infective agents ABBOTT LABORATORIES 2004-08-19 US disclosed
US-20040097492-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-20 US disclosed
US-20040087577-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-06 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 (4 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-20040097492-A1 Anti-infective agents POLR1C, RPL5, POLB KDM4E 4352/4885LMNA 3232/4885ALDH1A1 1434/4885
US-20040162285-A1 Anti-infective agents POLR1C, RPL5, POLB KDM4E 4352/4885LMNA 3232/4885ALDH1A1 1434/4885
US-20040167123-A1 Anti-infective agents SERPINB1, CYP51A1, ZC3HAV1 KDM4E 4075/4885LMNA 4000/4885ALDH1A1 891/4885
US-20040087577-A1 Anti-infective agents POLR1C, RPL5, POLB KDM4E 4352/4885LMNA 3232/4885ALDH1A1 1434/4885

“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.