SCHEMBL569668

SCHEMBL569668

Oc1ccc(-c2c3n(c4cccnc24)CCC3)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.44
PDE4A P27815 10/20 0.40
MAPK14 Q16539 3/20 0.39
THRB P10828 2/20 0.39
TGFBR1 P36897 1/20 0.39
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CG P48736 1/20 0.37
FABP1 P07148 1/20 0.36

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
SCHEMBL570812 0.79 PDE4A (0.44) PDE4AMAPK14THRBTGFBR1
SCHEMBL15064938 0.74 PDE4A (0.41) PDE4AMAPK14THRBTGFBR1
SCHEMBL569530 0.70 LMNA (0.36) PDE4AMAPK14
SCHEMBL13195235 0.69 ALOX5 (0.45) ALOX5MAPK14THRBTGFBR1
SCHEMBL12988020 0.66 ALOX5 (0.43) ALOX5MAPK14THRBTGFBR1
SCHEMBL11263577 0.64 GAA (0.47) ALOX5MAPK14THRBTGFBR1
SCHEMBL24852150 0.64 PDE4A (0.62) PDE4AMAPK14
SCHEMBL24851560 0.63 PDE4A (0.62) PDE4A
SCHEMBL11250873 0.63 GAA (0.52) ALOX5
SCHEMBL15064423 0.61 NAMPT (0.53)

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
EP-2601192-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICALS CO (JP) 2017-03-01 EP disclosed
US-9029536-B2 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-12 US disclosed
US-20130172292-A1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-07-04 US disclosed
EP-2601192-A1 FUSED HETEROCYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2013-06-12 EP disclosed
WO-2012018909-A1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-02-09 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-20130172292-A1 FUSED HETEROCYCLIC COMPOUNDS PDE10A, PDE3A, PDE2A ALOX5 4005/4885PDE4A 9/4885MAPK14 2956/4885

“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.