SCHEMBL3531791

SCHEMBL3531791

Cc1ccc2c(c1F)C(=O)C(=O)N2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 8/20 0.48
CDK2 P24941 1/20 0.40
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
DUSP3 P51452 1/20 0.39
BLM P54132 1/20 0.39
PTPN5 P54829 1/20 0.39
KMT2A Q03164 1/20 0.39
PTPN11 Q06124 1/20 0.39
MCL1 Q07820 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
BCHE P06276 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HTT P42858 1/20 0.37
ROS1 P08922 1/20 0.37
CDK5 Q00535 1/20 0.37
ACVR1 Q04771 1/20 0.37
LRRK2 Q5S007 1/20 0.37

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
SCHEMBL3743988 0.82 CES1 (0.50) CES1MAPTMEN1POLBDUSP3
SCHEMBL4586111 0.79 CES1 (0.52) CES1CDK2MAPTMEN1POLB
SCHEMBL7827616 0.78 MAPT (0.52) CES1MAPTMEN1POLBDUSP3
SCHEMBL3391317 0.78 CES1 (0.67) CES1MAPTMEN1POLBDUSP3
SCHEMBL15353216 0.78 CES1 (0.47) CES1CDK2MAPTMEN1POLB
SCHEMBL31728330 0.76 CES1 (0.48) CES1MAPTMEN1POLBDUSP3
SCHEMBL4700716 0.74 RET (0.48) CES1MAPTMEN1POLBDUSP3
SCHEMBL2136384 0.73 CES1 (0.60) CES1CDK2POLBROS1CDK5
SCHEMBL16111279 0.73 CES1 (0.42) CES1MAPTMEN1POLBDUSP3
SCHEMBL15257911 0.72 TDP2 (0.50) CES1MAPTPOLBBLMPTPN11

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-7749992-B2 Compounds and methods for treating dislipidemia ELI LILLY AND COMPANY (US) 2010-07-06 US disclosed
CN-101544573-A Preparation process of fluorine-containing anthranilic acid derivative BEIJING CHARNA CHEMICALS & PHA 2009-09-30 CN disclosed
EP-1670768-B1 COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA LILLY CO ELI (US) 2009-09-09 EP disclosed
EP-2098512-A1 Compounds and methods for treating dyslipidemia Eli Lilly & Company (US) 2009-09-09 EP disclosed
US-20070254869-A1 Compounds And Methods For Treating Dislipidemia ELI LILLY AND COMPANY (US) 2007-11-01 US disclosed
EP-1670768-A1 COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA ELI LILLY AND COMPANY (US) 2006-06-21 EP disclosed
WO-2005037796-A1 COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA ELI LILLY AND COMPANY (US) 2005-04-28 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 (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-20070254869-A1 Compounds And Methods For Treating Dislipidemia APOB, CETP, PCSK9 CES1 26/4885CDK2 2966/4885MAPT 4605/4885

“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.