SCHEMBL2070179

SCHEMBL2070179

COC(=O)C(=[N+]=[N-])C(=O)c1c(F)cccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
GAA P10253 9/20 0.43
RAB9A P51151 2/20 0.41
MAPT P10636 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
TYK2 P29597 1/20 0.41
POLB P06746 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40

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
SCHEMBL28359096 0.84 MEN1 (0.48) L3MBTL1GAARAB9AMAPTNPSR1
SCHEMBL2071081 0.75 GAA (0.43) GAARAB9AMAPTNPSR1JAK2
SCHEMBL2071083 0.75 GAA (0.43) GAARAB9AMAPTNPSR1JAK2
SCHEMBL14875422 0.74 CES2 (0.46) GAARAB9AMAPTNPSR1MEN1
SCHEMBL946028 0.74 LMNA (0.55) GAARAB9AMAPTNPSR1JAK2
SCHEMBL6935703 0.72 GAA (0.47) L3MBTL1GAARAB9AMAPTNPSR1
SCHEMBL6935698 0.72 GAA (0.47) L3MBTL1GAARAB9AMAPTNPSR1
SCHEMBL6640647 0.71 ALDH1A1 (0.45) L3MBTL1GAARAB9AMAPTNPSR1
SCHEMBL6935828 0.71 GAA (0.46) GAARAB9AMAPTNPSR1JAK2
SCHEMBL6935826 0.71 GAA (0.46) GAARAB9AMAPTNPSR1JAK2

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
EP-2522670-A1 Heterocyclic CRF receptor antagonists Takeda Pharmaceutical Company Limited (JP) 2012-11-14 EP disclosed
US-7897607-B2 Cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-01 US disclosed
EP-1732541-A4 CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2008-03-05 EP disclosed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 US disclosed
EP-1732541-A2 CYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2006-12-20 EP disclosed
WO-2005099688-A2 CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-10-27 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-20070179165-A1 Cyclic compounds CRHR1, CRHR2, MC2R L3MBTL1 4022/4885GAA 4637/4885RAB9A 1804/4885

“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.