SCHEMBL2473487

SCHEMBL2473487

NS(=O)(=O)N1CCC(C(=O)NCCc2cccc(C(F)(F)F)c2)(c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
TACR1 P25103 2/20 0.48
CHRM5 P08912 1/20 0.48
CHRM3 P20309 1/20 0.48
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CNR1 P21554 1/20 0.43
NAMPT P43490 1/20 0.43
TP53 P04637 1/20 0.43
MDM2 Q00987 1/20 0.43
CHRM4 P08173 1/20 0.43
PLA2G1B P04054 1/20 0.42
PKM P14618 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.41
CYP2C19 P33261 1/20 0.41
TSHR P16473 2/20 0.41
FSHR P23945 2/20 0.41
CA12 O43570 1/20 0.41

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
SCHEMBL2467123 0.86 ALDH1A1 (0.48) ALDH1A1TACR1CHRM5CHRM3NAMPT
SCHEMBL5349800 0.85 SMN1; SMN2 (0.55) TACR1CHRM5CHRM3CNR1NAMPT
SCHEMBL2513103 0.84 CHRM5 (0.49) TACR1CHRM5CHRM3MEN1KMT2A
SCHEMBL2465814 0.82 CHRM5 (0.48) TACR1CHRM5CHRM3CNR1NAMPT
SCHEMBL2473028 0.81 TSHR (0.44) TACR1CYP3A4GAACYP2C19TSHR
SCHEMBL2469740 0.81 TACR1 (0.48) TACR1CHRM5CHRM3MEN1KMT2A
SCHEMBL2465437 0.78 ALDH1A1 (0.78) ALDH1A1TACR1KMT2AGAATSHR
SCHEMBL5345935 0.77 TRPA1 (0.48) ALDH1A1TACR1CNR1NAMPTTP53
SCHEMBL2859744 0.76 CNR1 (0.59) TACR1MEN1KMT2ACNR1TP53
SCHEMBL5352499 0.76 TRPV1 (0.47) TACR1MEN1KMT2ACNR1NAMPT

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
EP-2371366-A1 Heterocyclo inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2011-10-05 EP disclosed
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2009-12-17 US disclosed
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2009-12-17 US disclosed
US-7582654-B2 Heterocyclo inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2009-09-01 US disclosed
US-7582654-B2 Heterocyclo inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2009-09-01 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 (1 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-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 ALDH1A1 3941/4885TACR1 3354/4885CHRM5 676/4885

“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.