SCHEMBL20140296

SCHEMBL20140296

Cc1ccc2c(I)nn(Cc3ccccc3F)c2n1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 13/20 0.45
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 1/20 0.41
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL16370144 0.90 PDE5A (0.55) PDE5AKMT2AADORA2AADORA1
SCHEMBL14746377 0.83 PDE5A (0.56) PDE5AKMT2ACYP1A2CYP2C19MEN1
SCHEMBL14746117 0.82 PDE5A (0.56) PDE5ACYP1A2CYP2C19ADORA2AADORA1
SCHEMBL20140367 0.81 TDP1 (0.45) PDE5AKMT2ACYP1A2CYP2C19ADORA2A
SCHEMBL174998 0.78 MAPT (0.53) PDE5A
SCHEMBL20139798 0.77 MEN1 (0.42) PDE5AKMT2ACYP1A2CYP2C19MEN1
SCHEMBL21787391 0.77 PDE5A (0.46) PDE5AADORA2AADORA1
SCHEMBL7803805 0.75 ALDH1A1 (0.49) KMT2AMEN1ALDH1A1
SCHEMBL174461 0.74 PDE5A (0.52) PDE5AKMT2AMEN1
SCHEMBL15169360 0.74 PDE5A (0.52) PDE5AKMT2AMEN1ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435080-B2 sGC stimulators TISENTO THERAPEUTICS INC. (US) 2025-10-07 US disclosed
US-20220017515-A1 sGC STIMULATORS TISENTO THERAPEUTICS INC. 2022-01-20 US disclosed
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-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
US-20200071318-A1 SGC STIMULATORS TISENTO THERAPEUTICS INC. 2020-03-05 US disclosed
EP-3538520-A2 SGC STIMULATORS Cyclerion Therapeutics, Inc. (US) 2019-09-18 EP disclosed
WO-2018089330-A2 SGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2018-05-17 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 (4 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 12/4885KMT2A 4675/4885CYP1A2 1927/4885
US-20220017515-A1 sGC STIMULATORS GUCY1A2, PRKG1, PDE2A PDE5A 12/4885KMT2A 4673/4885CYP1A2 2080/4885
US-12435080-B2 sGC stimulators GUCY1A2, PRKG1, PDE2A PDE5A 12/4885KMT2A 4673/4885CYP1A2 2080/4885
US-11180493-B2 SGC stimulators GUCY1A2, GMPS, PDE2A PDE5A 12/4885KMT2A 4675/4885CYP1A2 1927/4885

“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.