SCHEMBL2468682

SCHEMBL2468682

CN(C)S(=O)(=O)N1CCC(CNC(=O)c2nccnc2N)(c2ccccc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 13/20 0.51
MCHR1 Q99705 1/20 0.47
P2RX7 Q99572 2/20 0.44
LMNA P02545 1/20 0.41
ATR Q13535 1/20 0.40

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
SCHEMBL2470148 0.89 SLC6A9 (0.46) SLC6A9MCHR1P2RX7LMNAATR
SCHEMBL2467928 0.86 SLC6A9 (0.51) SLC6A9P2RX7LMNAATR
SCHEMBL2470323 0.86 SLC6A9 (0.45) SLC6A9MCHR1
SCHEMBL2496825 0.84 SLC6A9 (0.43) SLC6A9MCHR1P2RX7LMNA
SCHEMBL13175412 0.83 SLC6A9 (0.46) SLC6A9P2RX7
SCHEMBL2491201 0.82 MCHR1 (0.49) SLC6A9MCHR1LMNA
SCHEMBL13594085 0.82 P2RX7 (0.42) SLC6A9P2RX7LMNAATR
SCHEMBL2473533 0.82 P2RX7 (0.42) SLC6A9P2RX7LMNAATR
SCHEMBL2469913 0.81 P2RX7 (0.45) P2RX7LMNAATR
SCHEMBL2468582 0.81 HDAC3 (0.51) SLC6A9MCHR1LMNA

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
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
US-7005436-B2 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB COMPANY (US) 2006-02-28 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 SLC6A9 2351/4885MCHR1 3383/4885P2RX7 518/4885

“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.