SCHEMBL2471492

SCHEMBL2471492

COc1ccccc1C(=O)NC(C1(c2ccccc2)CCNCC1)S(=O)(=O)Nc1cccc(F)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 2/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
KCNK3 O14649 4/20 0.39
KCNK9 Q9NPC2 4/20 0.39
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
RXFP1 Q9HBX9 2/20 0.38
GAA P10253 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CASP3 P42574 1/20 0.37
ATM Q13315 1/20 0.37
MAPK1 P28482 1/20 0.37
KCNA3 P22001 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
SCHEMBL2472448 0.91 GAA (0.41) SMN1; SMN2NPC1RAB9AALDH1A1KMT2A
SCHEMBL2469444 0.91 ALDH1A1 (0.43) NPC1RAB9AKCNK3KCNK9ALDH1A1
SCHEMBL2471043 0.91 POLB (0.41) NPC1RAB9AKCNK3KCNK9ALDH1A1
SCHEMBL2701253 0.90 CASP3 (0.39) SMN1; SMN2LMNANPC1KCNK3KCNK9
SCHEMBL2471969 0.85 POLB (0.40) SMN1; SMN2ALDH1A1KMT2AMEN1HPGD
SCHEMBL2469955 0.85 ITGA4 (0.43) SMN1; SMN2LMNANPC1RAB9AALDH1A1
SCHEMBL2473766 0.84 SMN1; SMN2 (0.44) SMN1; SMN2LMNANPC1PKMRAB9A
SCHEMBL2467688 0.84 KDM4E (0.44) SMN1; SMN2LMNANPC1PKMRAB9A
SCHEMBL2467857 0.84 ALDH1A1 (0.45) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL2469730 0.84 ALDH1A1 (0.45) NPC1RAB9AALDH1A1KMT2AMEN1

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 6 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-7005436-B2 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB COMPANY (US) 2006-02-28 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 (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 SMN1; SMN2 4032/4885LMNA 1070/4885NPC1 989/4885

“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.