SCHEMBL20161156

SCHEMBL20161156

FC(F)(F)c1n[nH]c(-c2nc(CCC(F)(F)C(F)(F)F)c3ccccn23)n1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.34
HSD17B10 Q99714 1/20 0.32
HIF1A Q16665 3/20 0.31
EPAS1 Q99814 3/20 0.31

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
SCHEMBL20148877 0.79 AR (0.39) CNR2HSD17B10HIF1AEPAS1
SCHEMBL20141268 0.78 HIF1A (0.38) CNR2HSD17B10HIF1AEPAS1
SCHEMBL20148884 0.78 HIF1A (0.38) CNR2HSD17B10HIF1AEPAS1
SCHEMBL21564211 0.73 AR (0.38) CNR2HIF1AEPAS1
SCHEMBL20141064 0.69 PDE10A (0.30)
SCHEMBL14777105 0.68 CNR2 (0.34) CNR2
SCHEMBL20139673 0.68 AR (0.34)
SCHEMBL20140382 0.67 MAPK1 (0.44) CNR2HIF1A
SCHEMBL20148889 0.66 AR (0.35) HSD17B10
SCHEMBL19922669 0.66

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
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-2018111795-A2 USE OF SGC STIMULATORS FOR THE TREATMENT OF ESOPHAGEAL MOTILITY DISORDERS IRONWOOD PHARMACEUTICALS, INC. (US) 2018-06-21 WO 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 CNR2 1255/4885HSD17B10 2294/4885HIF1A 1126/4885
US-20220017515-A1 sGC STIMULATORS GUCY1A2, PRKG1, PDE2A CNR2 1268/4885HSD17B10 2420/4885HIF1A 1023/4885
US-11180493-B2 SGC stimulators GUCY1A2, GMPS, PDE2A CNR2 1255/4885HSD17B10 2294/4885HIF1A 1126/4885

“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.