SCHEMBL19687312

SCHEMBL19687312

Cc1cc(C)n(-c2cc(N3CCNC(C(N)=O)C3)nc(NC3CCC(F)(F)CC3)n2)n1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.42
FPR2 P25090 1/20 0.38
SCN9A Q15858 1/20 0.38
ADORA2A P29274 5/20 0.35
ADORA1 P30542 4/20 0.35
SYK P43405 2/20 0.35
IDH1 O75874 3/20 0.35
PRKD1 Q15139 2/20 0.35
PRKD2 Q9BZL6 2/20 0.35
HRH4 Q9H3N8 1/20 0.34
SMO Q99835 1/20 0.33
EIF2AK4 Q9P2K8 1/20 0.33
RAF1 P04049 1/20 0.33
PDE10A Q9Y233 1/20 0.33
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL19687216 0.88 ADORA2A (0.46) ADORA2AADORA1
SCHEMBL19686910 0.85 LRRK2 (0.38) FPR2SCN9AADORA2AADORA1SYK
SCHEMBL19687385 0.82 IDH1 (0.47) ADORA2AADORA1SYKIDH1HRH4
SCHEMBL19686365 0.81 IDH1 (0.48) IDH1TSHR
SCHEMBL19690825 0.79 PDE5A (0.42) PDE5AFPR2SCN9AADORA2AADORA1
SCHEMBL19687333 0.78 SMN1; SMN2 (0.53) ADORA2AADORA1IDH1HRH4RAF1
SCHEMBL19690935 0.78 FPR2 (0.45) PDE5AFPR2SCN9AADORA2AADORA1
SCHEMBL19691018 0.77 FPR2 (0.41) PDE5AFPR2SCN9AADORA2AADORA1
SCHEMBL19686357 0.77 IDH1 (0.40) IDH1PDE10A
SCHEMBL19686984 0.77 IDH1 (0.46) IDH1TSHRNPSR1

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 PDE5A 755/4885FPR2 4350/4885SCN9A 80/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 PDE5A 755/4885FPR2 4350/4885SCN9A 80/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 PDE5A 755/4885FPR2 4350/4885SCN9A 80/4885

“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.