SCHEMBL2468533

SCHEMBL2468533

N#Cc1cccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)(c3ccccc3)CC2)c1

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.76
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
MAPK1 P28482 2/20 0.48
USP2 O75604 2/20 0.47
CYP3A4 P08684 2/20 0.47
HIF1A Q16665 2/20 0.47
CYP1A2 P05177 1/20 0.47
OPRL1 P41146 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
OPRM1 P35372 1/20 0.46
TSHR P16473 1/20 0.46
LMNA P02545 2/20 0.45
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL2468317 0.85 ALDH1A1 (0.80) ALDH1A1KMT2AMEN1MAPK1USP2
SCHEMBL2472845 0.85 ALDH1A1 (0.80) ALDH1A1KMT2AMEN1MAPK1USP2
SCHEMBL14312443 0.84 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1MAPK1USP2
SCHEMBL2701896 0.83 KMT2A (0.57) ALDH1A1KMT2AMEN1MAPK1USP2
SCHEMBL2469356 0.80 ALDH1A1 (0.85) ALDH1A1KMT2AMEN1OPRL1SMN1; SMN2
SCHEMBL2469782 0.80 ALDH1A1 (0.85) ALDH1A1KMT2AOPRL1SMN1; SMN2TSHR
SCHEMBL2468167 0.78 ALDH1A1 (0.67) ALDH1A1KMT2AMEN1CYP3A4CYP1A2
SCHEMBL2465437 0.78 ALDH1A1 (0.78) ALDH1A1KMT2AOPRL1SMN1; SMN2OPRM1
SCHEMBL2465708 0.77 ALDH1A1 (0.80) ALDH1A1KMT2AMEN1OPRL1SMN1; SMN2
SCHEMBL13183011 0.76 ALDH1A1 (0.74) ALDH1A1KMT2AMEN1OPRL1SMN1; SMN2

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 13 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 claimed
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 ALDH1A1 3941/4885KMT2A 957/4885MEN1 3501/4885
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 ALDH1A1 3941/4885KMT2A 957/4885MEN1 3501/4885

“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.