SCHEMBL2468700

SCHEMBL2468700

Cn1c(C2(c3ccccc3)CCN(C(=O)CCc3ccccc3)CC2)nc2cc(F)ccc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.48
GFER P55789 1/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
OPRD1 P41143 9/20 0.43
NPC1 O15118 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
USP19 O94966 1/20 0.41
OPRK1 P41145 4/20 0.41
PRCP P42785 2/20 0.41
OPRM1 P35372 1/20 0.41
CCR5 P51681 1/20 0.41
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL2471547 0.85 CPT1A (0.55) KMT2AMEN1OPRD1TDP1OPRK1
SCHEMBL2465408 0.84 CPT1A (0.52) KMT2AMEN1OPRD1OPRK1ALDH1A1
SCHEMBL2465403 0.84 OPRD1 (0.54) OPRD1OPRK1OPRM1CCR5
SCHEMBL13593968 0.79 OPRD1 (0.36) OPRD1OPRK1PRCPOPRM1CCR5
SCHEMBL13593966 0.78 OPRD1 (0.35) EPHX2OPRD1OPRK1PRCPOPRM1
SCHEMBL13593972 0.77 OPRD1 (0.37) OPRD1OPRK1OPRM1CCR5ALDH1A1
SCHEMBL2469399 0.75 SMN1; SMN2 (0.52) KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL13593964 0.74 PKM (0.37) KMT2AMEN1OPRD1OPRK1OPRM1
SCHEMBL2473564 0.73 EPHX2 (0.44) EPHX2GFERKMT2AMEN1OPRD1
SCHEMBL2467312 0.73 ALDH1A1 (0.46) EPHX2KMT2AMEN1OPRD1NPC1

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 EPHX2 3772/4885GFER 1562/4885KMT2A 957/4885
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 EPHX2 3772/4885GFER 1562/4885KMT2A 957/4885

“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.