SCHEMBL3536306

SCHEMBL3536306

COC(=O)c1ccc(Br)cc1NC(=O)OC(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.51
KDM4E B2RXH2 9/20 0.49
ALDH1A1 P00352 7/20 0.49
HPGD P15428 4/20 0.45
GAA P10253 2/20 0.45
GLA P06280 1/20 0.45
ATM Q13315 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP3A4 P08684 1/20 0.44
NPC1 O15118 1/20 0.43
CYP2D6 P10635 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KMT2A Q03164 1/20 0.43
NR4A2 P43354 1/20 0.43
TSHR P16473 1/20 0.41

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
SCHEMBL2474712 0.89 ALDH1A1 (0.58) ABCG2KDM4EALDH1A1HPGDGAA
SCHEMBL3990612 0.80 ABCG2 (0.56) ABCG2KDM4EALDH1A1HPGDGAA
SCHEMBL29476211 0.80 ABCG2 (0.56) ABCG2KDM4EALDH1A1HPGDGAA
SCHEMBL459443 0.80 ABCG2 (0.51) ABCG2KDM4EALDH1A1HPGDGAA
SCHEMBL4585616 0.79 ABCG2 (0.49) ABCG2KDM4EALDH1A1HPGDGAA
SCHEMBL3532988 0.78 HPGD (0.42) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL27192085 0.78 ALDH1A1 (0.74) ABCG2KDM4EALDH1A1HPGDGAA
SCHEMBL5501186 0.77 KDM4E (0.47) KDM4EALDH1A1HPGDGAAATM
SCHEMBL9942862 0.77 ABCG2 (0.52) ABCG2KDM4EALDH1A1HPGDGAA
SCHEMBL21777655 0.77 KDM4E (0.58) ABCG2KDM4EALDH1A1HPGDGAA

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 ABCG2 242/4885KDM4E 3781/4885ALDH1A1 2112/4885

“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.