SCHEMBL2473492

SCHEMBL2473492

COc1cccc(O)c1C(=O)NCC1(c2cccc(F)c2)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 5/20 0.47
GPR119 Q8TDV5 2/20 0.42
TACR1 P25103 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 1/20 0.40
SLC6A9 P48067 1/20 0.39
KCNA3 P22001 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
ATM Q13315 1/20 0.38
ABCB1 P08183 1/20 0.38

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
SCHEMBL2472193 0.94 SOAT1 (0.41) SOAT1GPR119TACR1MEN1KMT2A
SCHEMBL2702111 0.90 SOAT1 (0.49) SOAT1TACR1MEN1KMT2AALDH1A1
SCHEMBL2474172 0.89 GPR119 (0.41) SOAT1GPR119TACR1ALDH1A1ABCB1
SCHEMBL2470395 0.88 MEN1 (0.55) SOAT1MEN1KMT2AALDH1A1SLC6A9
SCHEMBL12195690 0.85 MEN1 (0.56) SOAT1MEN1KMT2AALDH1A1SLC6A9
SCHEMBL2469960 0.84 SOAT1 (0.49) SOAT1MEN1KMT2AALDH1A1SLC6A9
SCHEMBL4218118 0.83 SLC6A9 (0.49) SOAT1MEN1KMT2AALDH1A1SLC6A9
SCHEMBL2471268 0.80 SLC6A9 (0.46) SOAT1MEN1KMT2AALDH1A1SLC6A9
SCHEMBL2471506 0.79 SLC6A9 (0.45) SOAT1MEN1KMT2AALDH1A1SLC6A9
SCHEMBL2470145 0.79 SOAT1 (0.47) SOAT1MEN1KMT2AALDH1A1SLC6A9

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 12 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
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 SOAT1 2745/4885GPR119 1209/4885TACR1 3354/4885
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 SOAT1 2745/4885GPR119 1209/4885TACR1 3354/4885

“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.