SCHEMBL19686936

SCHEMBL19686936

Cc1cc(C)n(-c2nc(NCc3ncco3)cc(NC3CCC(F)(F)CC3)n2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN2 Q9H2S1 1/20 0.48
KCNN3 Q9UGI6 1/20 0.48
ALDH1A1 P00352 4/20 0.38
ADORA2A P29274 6/20 0.37
NPSR1 Q6W5P4 4/20 0.35
ALOX15 P16050 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 3/20 0.35
TSHR P16473 2/20 0.35
IDH1 O75874 1/20 0.35
KDM4E B2RXH2 3/20 0.34
NR2F2 P24468 2/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
S1PR2 O95136 1/20 0.34
LMNA P02545 1/20 0.34
XBP1 P17861 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL19686616 0.86 KCNN2 (0.38) KCNN2KCNN3NPSR1MAPK1IDH1
SCHEMBL19687103 0.80 KCNN2 (0.39) KCNN2KCNN3ALDH1A1ADORA2ANPSR1
SCHEMBL19686335 0.80 KCNN2 (0.49) KCNN2KCNN3ALDH1A1ADORA2ANPSR1
SCHEMBL19686611 0.80 KCNN2 (0.58) KCNN2KCNN3ALDH1A1ADORA2ANPSR1
SCHEMBL19686804 0.79 KCNN3 (0.73) KCNN2KCNN3ALDH1A1NPSR1ALOX15
SCHEMBL21143669 0.79 KCNN2 (0.38) KCNN2KCNN3ALDH1A1ADORA2ANPSR1
SCHEMBL19686943 0.79 KCNN2 (0.57) KCNN2KCNN3ALDH1A1ADORA2ANPSR1
SCHEMBL19686330 0.79 KCNN2 (0.48) KCNN2KCNN3ALDH1A1ADORA2ANPSR1
SCHEMBL19686586 0.79 KCNN3 (0.53) KCNN2KCNN3ALDH1A1NPSR1ALOX15
SCHEMBL19686522 0.78 KCNN2 (0.58) KCNN2KCNN3ALDH1A1ADORA2ANPSR1

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 KCNN2 5/4885KCNN3 11/4885ALDH1A1 1320/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 KCNN2 5/4885KCNN3 11/4885ALDH1A1 1320/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 KCNN2 5/4885KCNN3 11/4885ALDH1A1 1320/4885

“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.