SCHEMBL2470787

SCHEMBL2470787

COc1ccccc1C(=O)NC(C1(c2ccccc2)CCNCC1)S(=O)(=O)NCC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
KCNA3 P22001 12/20 0.42
HPGD P15428 2/20 0.40
CTSD P07339 1/20 0.40
SLC6A9 P48067 1/20 0.40
ITGB1 P05556 1/20 0.37
ITGA4 P13612 1/20 0.37
ITGB7 P26010 1/20 0.37
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36
P2RX7 Q99572 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
SCHEMBL2699894 0.90 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL4403843 0.89 ALDH1A1 (0.42) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL2465850 0.88 HPGD (0.47) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL2471820 0.88 KCNA3 (0.44) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL2467857 0.87 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL2469730 0.87 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL2472137 0.86 KCNA3 (0.43) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL2471700 0.86 KCNA3 (0.45) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL2470694 0.86 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1KCNA3HPGD
SCHEMBL2471134 0.85 HPGD (0.41) ALDH1A1KMT2AMEN1KCNA3HPGD

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 9 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
EP-1501467-A4 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL MYERS SQUIBB CO (US) 2009-08-19 EP disclosed
US-7005436-B2 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB COMPANY (US) 2006-02-28 US disclosed
EP-1501467-A2 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION Bristol-Myers Squibb Company (US) 2005-02-02 EP disclosed
WO-2003088908-A2 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2003-10-30 WO 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 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.