SCHEMBL21144306

SCHEMBL21144306

Cc1csc(-c2cc(N3CCOCC3)cc(NC3CCC(O)CC3)n2)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.46
CCNT1 O60563 2/20 0.44
TTK P33981 1/20 0.40
IRAK4 Q9NWZ3 5/20 0.39
PIK3R2 O00459 4/20 0.39
FLT3 P36888 1/20 0.39
TYRO3 Q06418 1/20 0.39
MERTK Q12866 1/20 0.39
GAS6 Q14393 1/20 0.39
EML4 Q9HC35 1/20 0.38
ALK Q9UM73 1/20 0.38
PIK3CD O00329 1/20 0.37
PIK3CG P48736 1/20 0.37
PIK3C3 Q8NEB9 1/20 0.37
SYK P43405 4/20 0.36

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
SCHEMBL19686414 0.91 PIK3R2 (0.40) PIK3CACCNT1IRAK4PIK3R2SYK
SCHEMBL21165846 0.86 PIK3R2 (0.40) PIK3CAIRAK4PIK3R2
SCHEMBL19686418 0.84 IRAK4 (0.38) PIK3CAIRAK4PIK3R2SYK
SCHEMBL21165913 0.78 IDH1 (0.35) PIK3R2
SCHEMBL26604088 0.77 PIK3CA (0.53) PIK3CACCNT1TTKIRAK4FLT3
SCHEMBL26604081 0.76 HRH4 (0.57) PIK3CACCNT1TTKIRAK4FLT3
SCHEMBL19687111 0.75 HRH4 (0.34) PIK3R2
SCHEMBL21144073 0.75 PIK3R2 (0.47) PIK3R2
SCHEMBL21165847 0.73 IDH1 (0.36) IRAK4PIK3R2
SCHEMBL21165919 0.73 SYK (0.36) IRAK4SYK

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 5 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

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 PIK3CA 1182/4885CCNT1 4771/4885TTK 2532/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 PIK3CA 1182/4885CCNT1 4771/4885TTK 2532/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 PIK3CA 1182/4885CCNT1 4771/4885TTK 2532/4885

“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.