SCHEMBL20161260

SCHEMBL20161260

N/N=C(\N)c1nn(CCC(F)(F)C(F)(F)F)c2cc(Cl)ccc12

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.44
GUCY1A1 Q02108 18/20 0.41
GUCY1B1 Q02153 18/20 0.41
KMO O15229 1/20 0.38

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
SCHEMBL9980387 0.86 PDE5A (0.46) PDE5AGUCY1A1GUCY1B1
SCHEMBL15117031 0.81 PDE5A (0.44) PDE5AGUCY1A1GUCY1B1KMO
SCHEMBL21413147 0.76 KDM4C (0.41) PDE5AGUCY1A1GUCY1B1KMO
SCHEMBL18999258 0.74 KMO (0.42) PDE5AGUCY1A1GUCY1B1KMO
SCHEMBL20161332 0.74 GUCY1A1 (0.39) GUCY1A1GUCY1B1
SCHEMBL14776630 0.74 PDE5A (0.49) PDE5AGUCY1A1GUCY1B1KMO
SCHEMBL20161258 0.68 PDE5A (0.52) PDE5AGUCY1A1GUCY1B1
SCHEMBL14776861 0.65 GUCY1A1 (0.34) PDE5AGUCY1A1GUCY1B1
SCHEMBL15541683 0.63 KMO (0.51) KMO
SCHEMBL29781920 0.63 KMO (0.51) KMO

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-20220017515-A1 sGC STIMULATORS TISENTO THERAPEUTICS INC. 2022-01-20 US disclosed
US-11180493-B2 SGC stimulators CYCLERION THERAPEUTICS, INC. (US) 2021-11-23 US disclosed
US-20200071318-A1 SGC STIMULATORS TISENTO THERAPEUTICS INC. 2020-03-05 US disclosed
WO-2018089330-A2 SGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2018-05-17 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 (3 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-20200071318-A1 SGC STIMULATORS GUCY1A2, GMPS, PDE2A PDE5A 12/4885GUCY1A1 4/4885GUCY1B1 6/4885
US-20220017515-A1 sGC STIMULATORS GUCY1A2, PRKG1, PDE2A PDE5A 12/4885GUCY1A1 4/4885GUCY1B1 6/4885
US-11180493-B2 SGC stimulators GUCY1A2, GMPS, PDE2A PDE5A 12/4885GUCY1A1 4/4885GUCY1B1 6/4885

“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.