SCHEMBL19686910

SCHEMBL19686910

Cc1cc(C)n(-c2cc(N3CCOC(C(N)=O)C3)nc(NC3CCC(F)(F)CC3)n2)n1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.38
ADORA2A P29274 9/20 0.37
ADORA1 P30542 8/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
RAF1 P04049 1/20 0.37
FPR2 P25090 1/20 0.37
SCN9A Q15858 1/20 0.37
SYK P43405 2/20 0.35
IDH1 O75874 3/20 0.35
HRH4 Q9H3N8 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
KCNH2 Q12809 1/20 0.32

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
SCHEMBL19686902 0.87 ADORA2A (0.50) ADORA2AADORA1
SCHEMBL19687312 0.85 PDE5A (0.42) ADORA2AADORA1RAF1FPR2SCN9A
SCHEMBL19687333 0.84 SMN1; SMN2 (0.53) LRRK2ADORA2AADORA1SMN1; SMN2RAF1
SCHEMBL19687385 0.82 IDH1 (0.47) ADORA2AADORA1SMN1; SMN2RAF1SYK
SCHEMBL19686365 0.81 IDH1 (0.48) SMN1; SMN2IDH1
SCHEMBL19686357 0.79 IDH1 (0.40) SMN1; SMN2IDH1
SCHEMBL19686911 0.79 ADORA2A (0.38) ADORA2AADORA1
SCHEMBL19700464 0.79 FPR2 (0.41) ADORA2AADORA1SMN1; SMN2FPR2SCN9A
SCHEMBL19700463 0.79 FPR2 (0.41) ADORA2AADORA1SMN1; SMN2FPR2SCN9A
SCHEMBL19690930 0.79 FPR2 (0.41) ADORA2AADORA1SMN1; SMN2FPR2SCN9A

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 LRRK2 1193/4885ADORA2A 1711/4885ADORA1 1011/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 LRRK2 1193/4885ADORA2A 1711/4885ADORA1 1011/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 LRRK2 1193/4885ADORA2A 1711/4885ADORA1 1011/4885

“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.