SCHEMBL2070778

SCHEMBL2070778

Cc1cc(C)c(-c2nn(C)c3nc(OC(C)C)n(C)c(=O)c23)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.39
CRHR1 P34998 11/20 0.35
HCRTR1 O43613 4/20 0.31
HCRTR2 O43614 4/20 0.31
BRD4 O60885 1/20 0.31
BTK Q06187 1/20 0.30

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
SCHEMBL2070850 0.87 CRHR1 (0.38) PDE5ACRHR1
SCHEMBL2072129 0.83 PDE5A (0.34) PDE5ACRHR1BTK
SCHEMBL2072335 0.74 CRHR1 (0.40) CRHR1
SCHEMBL2069671 0.72 CRHR1 (0.69) CRHR1
SCHEMBL2070016 0.71 CRHR1 (0.37) CRHR1
SCHEMBL2069735 0.68 CRHR1 (0.44) CRHR1
SCHEMBL2071085 0.60 CRHR1 (0.64) CRHR1
SCHEMBL2070359 0.60 CRHR1 (0.38) CRHR1
SCHEMBL2072664 0.58 CRHR1 (0.62) CRHR1
SCHEMBL13006848 0.58 BRPF1 (0.38) PDE5ABRD4

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-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-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
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 PDE5A 1398/4885CRHR1 1/4885HCRTR1 14/4885

“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.