SCHEMBL2072272

SCHEMBL2072272

CCCN(CCC)c1nc2nn(Cc3ccccc3)c(-c3ccc(C)cc3C)c2c(=O)n1C

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 15/20 0.55
TDP2 O95551 1/20 0.35
KLK7 P49862 1/20 0.35
PDE6D O43924 1/20 0.34
PDE5A O76074 1/20 0.34
PDE6A P16499 1/20 0.34
PDE6G P18545 1/20 0.34
PDE6B P35913 1/20 0.34
PDE6C P51160 1/20 0.34
PDE6H Q13956 1/20 0.34

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
SCHEMBL2071829 0.89 CRHR1 (0.53) CRHR1TDP2
SCHEMBL2069612 0.85 CRHR1 (0.63) CRHR1
SCHEMBL2070125 0.84 CHRM1 (0.39) CRHR1TDP2KLK7PDE5A
SCHEMBL2069984 0.76 CRHR1 (0.67) CRHR1
SCHEMBL2070192 0.75 CRHR1 (0.69) CRHR1
SCHEMBL2072238 0.74 KDM4E (0.41) KLK7
SCHEMBL12775207 0.74 CRHR1 (0.62) CRHR1
SCHEMBL2072664 0.73 CRHR1 (0.62) CRHR1
SCHEMBL2072545 0.72 CRHR1 (0.70) CRHR1
SCHEMBL12775494 0.72 CRHR1 (1.00) 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 5 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
US-7897607-B2 Cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-01 US disclosed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 US disclosed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 US 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 CRHR1 1/4885TDP2 4878/4885KLK7 4013/4885

“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.