SCHEMBL5230998

SCHEMBL5230998

CCOC(=O)c1c(O)c2cc(C)ccc2c(=O)n1CC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
MAPK8 P45983 1/20 0.40
PNP P00491 1/20 0.40
ALDH1A1 P00352 9/20 0.39
MAPT P10636 3/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 2/20 0.38
ELANE P08246 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 1/20 0.38
HTT P42858 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RECQL P46063 1/20 0.37
HPGD P15428 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
SCHEMBL5235788 0.95 KDM4E (0.41) KDM4EMAPK8PNPALDH1A1MAPT
SCHEMBL5238679 0.88 ALDH1A1 (0.50) KDM4EMAPK8ALDH1A1MAPTGAA
SCHEMBL5239883 0.88 PTGDR2 (0.40) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL5276033 0.86 KDM4E (0.52) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL5236157 0.86 RORA (0.41) KDM4EALDH1A1MAPTNPC1HPGD
SCHEMBL5236394 0.86 KDM4E (0.46) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL5237473 0.84 ALDH1A1 (0.41) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL5233862 0.84 KDM4E (0.40) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL5576875 0.84 ALDH1A1 (0.50) KDM4EMAPK8ALDH1A1MAPTGAA
SCHEMBL5235266 0.83 TNF (0.42) KDM4EALDH1A1MAPTGAANPSR1

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
EP-1355886-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2007-07-11 EP disclosed
US-20070117840-A1 Receptor antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-24 US disclosed
US-7034039-B2 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-25 US disclosed
EP-1604983-A1 RECEPTOR ANTAGONIST Takeda Pharmaceutical Company Limited (JP) 2005-12-14 EP disclosed
US-20040082607-A1 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-29 US disclosed
EP-1355886-A1 FUSED HETEROCYCLIC COMPOUNDS Takeda Chemical Industries, Ltd. (JP) 2003-10-29 EP disclosed
WO-2002062764-A1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-08-15 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 (2 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-20040082607-A1 Fused heterocyclic compounds DPP7, DPP4, METAP1 KDM4E 897/4885MAPK8 2612/4885PNP 2389/4885
US-20070117840-A1 Receptor antagonist FSHR, NR4A1, GHRHR KDM4E 2749/4885MAPK8 1528/4885PNP 3276/4885

“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.