SCHEMBL4479301

SCHEMBL4479301

CCc1cc(OC)ccc1-c1nc2c(C)cc(C(CC)CC)cn2c1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 11/20 0.46
RAD52 P43351 1/20 0.35
PABPC1 P11940 1/20 0.34
TGFBR1 P36897 1/20 0.33
AKR1C3 P42330 3/20 0.33
AKR1C2 P52895 3/20 0.33
AKR1C1 Q04828 1/20 0.33
PTGS1 P23219 1/20 0.33
TSPO P30536 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL4498283 0.92 CRHR1 (0.54) CRHR1RAD52PABPC1
SCHEMBL4500640 0.92 CRHR1 (0.47) CRHR1AKR1C3AKR1C2KDM4E
SCHEMBL4483814 0.90 CRHR1 (0.45) CRHR1
SCHEMBL4494259 0.87 CRHR1 (0.44) CRHR1RAD52
SCHEMBL4494321 0.84 CRHR1 (0.44) CRHR1AKR1C3AKR1C2KDM4E
SCHEMBL4479812 0.82 CRHR1 (0.39) CRHR1TSPOKDM4E
SCHEMBL4489221 0.82 CRHR1 (0.37) CRHR1
SCHEMBL4499176 0.81 CRHR1 (0.46) CRHR1
SCHEMBL4482511 0.81 CRHR1 (0.46) CRHR1
SCHEMBL4492009 0.81 CRHR1 (0.36) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090281120-A1 BICYCLIC HETEROCYCLIC COMPOUND ONO PHARMACEUTICAL CO., LTD (JP) 2009-11-12 US claimed
EP-1961745-A1 BICYCLIC HETEROCYCLIC COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2008-08-27 EP claimed
US-20090281120-A1 BICYCLIC HETEROCYCLIC COMPOUND ONO PHARMACEUTICAL CO., LTD (JP) 2009-11-12 US disclosed
EP-1961745-A1 BICYCLIC HETEROCYCLIC COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2008-08-27 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-20090281120-A1 BICYCLIC HETEROCYCLIC COMPOUND CRHR1, NR3C1, CNR1 CRHR1 1/4885RAD52 2839/4885PABPC1 4677/4885

“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.