SCHEMBL5034499

SCHEMBL5034499

CCOc1ccc(C=O)cc1CNC(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.51
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 4/20 0.42
POLB P06746 2/20 0.41
GAA P10253 1/20 0.41
TACR2 P21452 1/20 0.40
KDM4A O75164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
TOP2A P11388 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
SCHEMBL4339307 0.88 KDM4E (0.49) ALDH1A1KMT2AKDM4EPOLBKDM4A
SCHEMBL6681076 0.85 MAPK1 (0.45) ALDH1A1KMT2AKDM4EGAAKDM4A
SCHEMBL30101803 0.82 ALDH1A1 (0.48) ALDH1A1KMT2AGAASMN1; SMN2TDP1
SCHEMBL20869029 0.82 ALDH1A1 (0.48) ALDH1A1KMT2AGAASMN1; SMN2TDP1
SCHEMBL31420797 0.82 EGFR (0.43) ALDH1A1KDM4EPOLBKDM4ASMN1; SMN2
SCHEMBL2522260 0.81 NPC1 (0.42) ALDH1A1KDM4EPOLBGAAKDM4A
SCHEMBL12206607 0.81 KDM4A (0.41) ALDH1A1KMT2AKDM4EPOLBGAA
SCHEMBL2553317 0.81 KDM4A (0.41) ALDH1A1KMT2AKDM4EPOLBGAA
SCHEMBL6676086 0.79 NPBWR1 (0.54) ALDH1A1KMT2APOLBSMN1; SMN2L3MBTL1
SCHEMBL6677097 0.77 ALDH1A1 (0.46) ALDH1A1GAATDP1MAPT

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-7371777-B2 Cyclic compound and PPAR agonist EISAI CO., LTD. (JP) 2008-05-13 US disclosed
US-20050014833-A1 Cyclic compound and ppar agonist EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-20 US disclosed
EP-1452521-A1 CYCLIC COMPOUND AND PPAR AGONIST Eisai Co., Ltd. (JP) 2004-09-01 EP 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-20050014833-A1 Cyclic compound and ppar agonist PPARA, PPARG, PPARD ALDH1A1 1662/4885KMT2A 1549/4885KDM4E 2818/4885

“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.