SCHEMBL19686629

SCHEMBL19686629

COc1ccc(CNc2cc(NC3CCC(F)(F)CC3)nc(-n3nc(C)cc3C)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 10/20 0.49
ADORA2A P29274 2/20 0.40
CYP3A4 P08684 1/20 0.40
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HIF1A Q16665 1/20 0.39
KCNN2 Q9H2S1 1/20 0.38
KCNN3 Q9UGI6 1/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SLC34A1 Q06495 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
RAB9A P51151 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL19686886 0.85 PDE2A (0.42) PDE2AADORA2ACYP3A4LMNANPSR1
SCHEMBL21165991 0.83 KCNN2 (0.46) PDE2AADORA2ACYP3A4LMNANPSR1
SCHEMBL19686334 0.82 KCNN2 (0.43) ADORA2ANPSR1KCNN2KCNN3KDM4E
SCHEMBL19686952 0.81 KCNN2 (0.39) LMNANPSR1KCNN2KCNN3KDM4E
SCHEMBL19686711 0.81 KCNN2 (0.43) PDE2AADORA2ALMNANPSR1KCNN2
SCHEMBL31127352 0.81 KCNN2 (0.43) PDE2AADORA2ALMNANPSR1KCNN2
SCHEMBL19686624 0.80 KCNN2 (0.38) ADORA2AKCNN2KCNN3
SCHEMBL19686616 0.79 KCNN2 (0.38) NPSR1KCNN2KCNN3KDM4EMAPT
SCHEMBL19686874 0.79 KCNN2 (0.38) NPSR1KCNN2KCNN3KDM4EMAPT
SCHEMBL19687319 0.77 KCNN2 (0.46) ADORA2ALMNANPSR1KCNN2KCNN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240317705-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2024-09-26 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
WO-2017139697-A9 BACTERIA ENGINEERED TO TREAT DISEASES ASSOCIATED WITH HYPERAMMONEMIA SYNLOGIC, INC. (US) 2017-12-07 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-20240317705-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 PDE2A 758/4885ADORA2A 1711/4885CYP3A4 1136/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 PDE2A 758/4885ADORA2A 1711/4885CYP3A4 1136/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 PDE2A 758/4885ADORA2A 1711/4885CYP3A4 1136/4885

“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.