SCHEMBL2472040

SCHEMBL2472040

NS(=O)(=O)N1CCC(CNS(=O)(=O)c2ccccc2OC(F)(F)F)(c2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.47
CYP2C9 P11712 1/20 0.46
CNR2 P34972 1/20 0.46
TACR1 P25103 1/20 0.40
SLC6A9 P48067 3/20 0.39
LIPE Q05469 1/20 0.38
HSD11B1 P28845 1/20 0.38
HSD11B2 P80365 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALPL P05186 1/20 0.37
SLC22A12 Q96S37 3/20 0.36
SLC40A1 Q9NP59 1/20 0.36
TRPV4 Q9HBA0 1/20 0.36
OPRD1 P41143 1/20 0.36
PTGES2 Q9H7Z7 1/20 0.36
KDM2B Q8NHM5 1/20 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
SCHEMBL2468238 0.85 CYP2C9 (0.43) CCR1CYP2C9CNR2TACR1SLC6A9
SCHEMBL2467728 0.80 SLC6A9 (0.60) SLC6A9MEN1KMT2A
SCHEMBL13593830 0.77 CCR1 (0.41) CCR1CYP2C9CNR2TACR1SLC6A9
SCHEMBL2703164 0.73 CCR1 (0.39) CCR1CYP2C9CNR2SLC6A9LIPE
SCHEMBL2867340 0.71 CCR1 (0.43) CCR1CNR2SLC6A9ALPLSLC22A12
SCHEMBL26922834 0.71 KMT2A (0.46) CCR1MEN1KMT2A
SCHEMBL12491364 0.69 SMN1; SMN2 (0.54) KMT2AALPLSLC22A12SLC40A1
SCHEMBL2701835 0.69 MAOA (0.61) TACR1SLC6A9KMT2AOPRD1
SCHEMBL5585095 0.68 SLC6A9 (0.80) SLC6A9MEN1KMT2A
SCHEMBL26921161 0.68 TACR1 (0.49) CCR1TACR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2228065-B1 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB CO (US) 2012-12-26 EP disclosed
EP-1501467-B1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL MYERS SQUIBB CO (US) 2012-05-09 EP disclosed
EP-2371366-A1 Heterocyclo inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2011-10-05 EP disclosed
EP-2228065-A2 Heterocyclo inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2010-09-15 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-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
US-7582654-B2 Heterocyclo inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2009-09-01 US disclosed
US-7005436-B2 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB COMPANY (US) 2006-02-28 US disclosed
US-20060014792-A1 Heterocyclo inhibitors of potassium channel function LLOYD JOHN 2006-01-19 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 (2 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-20060014792-A1 Heterocyclo inhibitors of potassium channel function KCNJ2, KCNH2, KCNQ5 CCR1 4740/4885CYP2C9 2232/4885CNR2 1925/4885
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 CCR1 4740/4885CYP2C9 2232/4885CNR2 1925/4885

“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.