SCHEMBL2469356

SCHEMBL2469356

CCc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)(c3ccccc3)CC2)cc1

nearest known ligand 0.85

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.85
HSD11B1 P28845 1/20 0.60
CYP2C19 P33261 1/20 0.57
KMT2A Q03164 2/20 0.56
OPRL1 P41146 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
TSHR P16473 1/20 0.54
FKBP1A P62942 1/20 0.53
OPRM1 P35372 1/20 0.53
NAMPT P43490 1/20 0.53
PKM P14618 1/20 0.50
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.48

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
SCHEMBL2469782 0.89 ALDH1A1 (0.85) ALDH1A1CYP2C19KMT2AOPRL1SMN1; SMN2
SCHEMBL2465708 0.89 ALDH1A1 (0.80) ALDH1A1HSD11B1CYP2C19KMT2AOPRL1
SCHEMBL2472845 0.84 ALDH1A1 (0.80) ALDH1A1CYP2C19KMT2AOPRL1SMN1; SMN2
SCHEMBL14312625 0.83 ALDH1A1 (0.60) ALDH1A1HSD11B1CYP2C19KMT2ASMN1; SMN2
SCHEMBL2465437 0.83 ALDH1A1 (0.78) ALDH1A1KMT2AOPRL1SMN1; SMN2TSHR
SCHEMBL2468317 0.82 ALDH1A1 (0.80) ALDH1A1CYP2C19KMT2AOPRL1SMN1; SMN2
SCHEMBL2470399 0.81 ALDH1A1 (0.71) ALDH1A1KMT2AOPRL1SMN1; SMN2TSHR
SCHEMBL13183011 0.81 ALDH1A1 (0.74) ALDH1A1KMT2AOPRL1SMN1; SMN2TSHR
SCHEMBL2468976 0.81 ALDH1A1 (0.70) ALDH1A1CYP2C19KMT2AOPRL1SMN1; SMN2
SCHEMBL13182923 0.80 ALDH1A1 (0.67) ALDH1A1KMT2AOPRL1SMN1; SMN2TSHR

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 3941/4885HSD11B1 4246/4885CYP2C19 3045/4885
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 ALDH1A1 3941/4885HSD11B1 4246/4885CYP2C19 3045/4885

“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.