SCHEMBL6371069

SCHEMBL6371069

Cc1c(N2CCC(CO)(CO)CC2)ccc2c(=O)[nH]c(=O)n(C3CC3)c12

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EEF2K O00418 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRK1 P41145 1/20 0.34
OPRL1 P41146 1/20 0.34
JAK2 O60674 3/20 0.33
JAK1 P23458 3/20 0.33
JAK3 P52333 3/20 0.33
TYK2 P29597 2/20 0.33
LMNA P02545 3/20 0.32
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTPN11 Q06124 1/20 0.31
MAPK1 P28482 1/20 0.30
PARG Q86W56 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL6371238 0.90 JAK2 (0.34) EEF2KOPRM1OPRK1OPRL1JAK2
SCHEMBL6371708 0.86 KCNH2 (0.37) EEF2KOPRM1OPRK1OPRL1JAK2
SCHEMBL6371072 0.81 EEF2K (0.35) EEF2KOPRL1JAK2JAK1JAK3
SCHEMBL6371180 0.81 KCNH2 (0.33) EEF2KOPRL1JAK2JAK1JAK3
SCHEMBL6377144 0.80 EEF2K (0.33) EEF2KJAK2JAK1JAK3LMNA
SCHEMBL6379079 0.80 KCNH2 (0.42)
SCHEMBL6378795 0.80 PTPN11 (0.34) LMNAPTPN11
SCHEMBL6371429 0.79 TK1 (0.36) EEF2KOPRK1JAK2JAK1JAK3
SCHEMBL6370154 0.79 TK1 (0.36) EEF2KJAK2JAK1JAK3TYK2
SCHEMBL6372031 0.77 KCNH2 (0.37) EEF2KOPRM1OPRK1OPRL1JAK2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005051381-A1 Substituted urea-octatydroindols as antagonists of melanin concentrating hormone receptor 1 (MCH1R) BIOVITRUM AB (SE) 2005-06-09 WO claimed
US-20050096278-A1 Antibacterial agents ELLSWORTH EDMUND L (US) 2005-05-05 US claimed
WO-2005026145-A2 QUINOLONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2005-03-24 WO claimed
US-20050096278-A1 Antibacterial agents ELLSWORTH EDMUND L (US) 2005-05-05 US disclosed
WO-2005026145-A2 QUINOLONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2005-03-24 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-20050096278-A1 Antibacterial agents MRPL21, FBL, SDHA EEF2K 715/4885OPRM1 1772/4885OPRK1 1361/4885

“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.