SCHEMBL20153240

SCHEMBL20153240

O=C(O)N(c1cc(N2CCOCC2)nc(-n2ccc(C3CC3)n2)n1)C1CCC(F)(F)CC1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAPEPLD Q6IQ20 6/20 0.33
PIK3CA P42336 3/20 0.33
MTOR P42345 1/20 0.33
ALDH1A1 P00352 2/20 0.32
PIK3R1 P27986 2/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
BLM P54132 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PKM P14618 1/20 0.32
CREBBP Q92793 1/20 0.32
IDH1 O75874 1/20 0.32
RAF1 P04049 2/20 0.31
BRAF P15056 2/20 0.31
SHMT2 P34897 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
GBA1 P04062 1/20 0.31

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
SCHEMBL19686895 0.88 ATR (0.33) PIK3CAMTORPIK3R1POLBCREBBP
SCHEMBL19686896 0.77 IDH1 (0.42) PIK3CAALDH1A1POLBHPGDIDH1
SCHEMBL20153241 0.77 RAF1 (0.35) NAPEPLDPIK3CAALDH1A1CREBBPIDH1
SCHEMBL20399551 0.77 KMT2A (0.46) NAPEPLDALDH1A1HPGDHSD17B10PKM
SCHEMBL21143733 0.77 PIK3CA (0.41) PIK3CAMTORALDH1A1HSD17B10PKM
SCHEMBL21143805 0.76 PIK3CB (0.33) NAPEPLDPIK3CAMTORALDH1A1POLB
SCHEMBL20399778 0.76 RAF1 (0.39) NAPEPLDPIK3CAMTORPKMCREBBP
SCHEMBL19686424 0.74 CHRM3 (0.41) PIK3CAALDH1A1POLBHPGDIDH1
SCHEMBL21144115 0.72 ADORA2A (0.35) NAPEPLDCREBBPGBA1
SCHEMBL21144188 0.72 IDH1 (0.33) IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210380571-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS INC (US) 2021-12-09 US disclosed
EP-3571193-B1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS INC (US) 2021-12-01 EP disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-10717728-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-07-21 US disclosed
US-20190352293-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-11-21 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-10351553-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2019-07-16 US disclosed
US-20180215746-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2018-08-02 US disclosed
WO-2018136917-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. (US) 2018-07-26 WO disclosed
US-9975886-B1 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2018-05-22 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 (7 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-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 NAPEPLD 1989/4885PIK3CA 1182/4885MTOR 1488/4885
US-20210380571-A1 POTASSIUM CHANNEL MODULATORS KCNJ2, KCNK10, KCNJ1 NAPEPLD 2285/4885PIK3CA 1682/4885MTOR 2274/4885
US-10717728-B2 Potassium channel modulators KCNJ2, KCNQ2, KCNJ1 NAPEPLD 1675/4885PIK3CA 1117/4885MTOR 1751/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 NAPEPLD 1989/4885PIK3CA 1182/4885MTOR 1488/4885
US-20190352293-A1 POTASSIUM CHANNEL MODULATORS KCNJ2, KCNK10, KCNJ1 NAPEPLD 2285/4885PIK3CA 1682/4885MTOR 2274/4885
US-20180215746-A1 POTASSIUM CHANNEL MODULATORS KCNJ2, KCNK10, KCNJ1 NAPEPLD 2285/4885PIK3CA 1682/4885MTOR 2274/4885
US-10351553-B2 Potassium channel modulators KCNN2, KCNN1, KCNN3 NAPEPLD 1970/4885PIK3CA 1148/4885MTOR 1038/4885

“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.