SCHEMBL3533762

SCHEMBL3533762

COC(=O)CCCN(C(=O)OC(C)(C)C)c1ccc(C(F)(F)F)cc1C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.42
MLYCD O95822 4/20 0.39
RXRA P19793 6/20 0.39
NR1H2 P55055 6/20 0.39
NR1H3 Q13133 4/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
CNR2 P34972 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.36
TRPV4 Q9HBA0 2/20 0.36
RXFP1 Q9HBX9 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 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
SCHEMBL3530484 0.84 MLYCD (0.36) CFTRMLYCDRXRANR1H2NR1H3
SCHEMBL22507939 0.80 CFTR (0.51) CFTRRXRANR1H2NR1H3MAPT
SCHEMBL3538678 0.79 APP (0.34) MLYCD
SCHEMBL3532872 0.79 MAPT (0.41) MAPTRXFP1ALDH1A1KMT2A
SCHEMBL20614753 0.71 KDM4E (0.35) KDM4EALDH1A1LMNAHPGD
SCHEMBL13737598 0.71 ALDH1A1 (0.41) MLYCDMEN1ALDH1A1LMNAKMT2A
SCHEMBL2472493 0.70 NR4A2 (0.37) MLYCDKDM4EMEN1ALDH1A1LMNA
SCHEMBL23877503 0.70 CFTR (0.54) CFTRKDM4EMAPTMRGPRX4ALDH1A1
SCHEMBL1451872 0.69 CFTR (0.53) CFTRKDM4EMAPTCNR2MRGPRX4
Ammonia Solution, Strong SCHEMBL28740935 0.69 CFTR (0.60) CFTRRXRANR1H2NR1H3KDM4E

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 6 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
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 CFTR 1703/4885MLYCD 2428/4885RXRA 91/4885

“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.