SCHEMBL20141415

SCHEMBL20141415

NC(=O)c1nn(Cc2ccccc2F)c2nnccc12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CFD P00746 2/20 0.41
PIK3CD O00329 1/20 0.40
ATM Q13315 2/20 0.39
AURKA O14965 1/20 0.39
RPS6KB1 P23443 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
KCNH2 Q12809 1/20 0.39
BUB1 O43683 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 3/20 0.38
PDE5A O76074 2/20 0.38
ADORA2A P29274 2/20 0.37
ADORA1 P30542 2/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL31120359 0.88 ADORA3 (0.37) PIK3CDATMADORA3KCNH2MEN1
SCHEMBL4929205 0.84 ATM (0.53) CFDATMAURKARPS6KB1ADORA3
SCHEMBL4937101 0.84 ATM (0.53) CFDATMAURKARPS6KB1ADORA3
SCHEMBL20139798 0.79 MEN1 (0.42) MEN1KMT2AALDH1A1PDE5AADORA2A
SCHEMBL31120363 0.79 GRM2 (0.44) ADORA3MEN1KMT2AALDH1A1ADORA2A
SCHEMBL15121029 0.78 PDE5A (0.51) PIK3CDATMAURKARPS6KB1ADORA3
SCHEMBL174635 0.78 PDE5A (0.48) PIK3CDADORA3KCNH2PDE5A
Hydrochloric Acid SCHEMBL29219152 0.77 PDE5A (0.47) PIK3CDPDE5A
SCHEMBL12480049 0.77 CFD (0.41) CFDALDH1A1
SCHEMBL20139791 0.76 BUB1 (0.51) CFDBUB1

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 CFD 2964/4885PIK3CD 2054/4885ATM 338/4885
US-20220017515-A1 sGC STIMULATORS GUCY1A2, PRKG1, PDE2A CFD 3021/4885PIK3CD 2003/4885ATM 332/4885
US-12435080-B2 sGC stimulators GUCY1A2, PRKG1, PDE2A CFD 3021/4885PIK3CD 2003/4885ATM 332/4885
US-11180493-B2 SGC stimulators GUCY1A2, GMPS, PDE2A CFD 2964/4885PIK3CD 2054/4885ATM 338/4885

“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.