SCHEMBL2701428

SCHEMBL2701428

O=C(O)C1(Cc2ccccc2)CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
MEN1 O00255 2/20 0.55
HSD11B1 P28845 1/20 0.55
CYP2D6 P10635 2/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
POLB P06746 2/20 0.53
ALDH1A1 P00352 1/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
HTT P42858 1/20 0.53
NR3C1 P04150 1/20 0.52
PKM P14618 2/20 0.50
USP2 O75604 1/20 0.50

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
SCHEMBL8877209 0.95 CYP2D6 (0.57) KMT2AMEN1HSD11B1CYP2D6SMN1; SMN2
SCHEMBL2702763 0.91 CYP2D6 (0.64) KMT2AMEN1CYP2D6SMN1; SMN2POLB
SCHEMBL2701737 0.88 PKM (0.57) KMT2ACYP2D6SMN1; SMN2POLBALDH1A1
SCHEMBL2703307 0.88 CYP2C19 (0.64) KMT2AMEN1CYP2D6SMN1; SMN2POLB
SCHEMBL2699819 0.84 LMNA (0.60) KMT2AMEN1HSD11B1CYP2D6ALDH1A1
SCHEMBL2703397 0.82 PKM (0.52) KMT2AMEN1CYP2D6SMN1; SMN2ALDH1A1
SCHEMBL2701353 0.82 KMT2A (0.58) KMT2AMEN1CYP2D6
SCHEMBL8877723 0.81 CYP2D6 (0.57) KMT2AMEN1CYP2D6SMN1; SMN2POLB
SCHEMBL2469016 0.80 KMT2A (0.51) KMT2AMEN1HSD11B1SMN1; SMN2POLB
SCHEMBL8877293 0.80 CYP2D6 (0.53) KMT2AMEN1CYP2D6SMN1; SMN2POLB

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 7 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-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-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 KMT2A 957/4885MEN1 3501/4885HSD11B1 4246/4885
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 KMT2A 957/4885MEN1 3501/4885HSD11B1 4246/4885

“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.