SCHEMBL2465508

SCHEMBL2465508

COc1ccc(CNC(=O)C2(c3ccccc3)CCN(C(=O)C3CC3c3ccccc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.54
▸ OPRD1 P41143 1/20 0.54
▸ CHRM5 P08912 2/20 0.54
▸ CHRM3 P20309 2/20 0.54
▸ NPY1R P25929 1/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ OPRL1 P41146 3/20 0.48
▸ OPRM1 P35372 1/20 0.48
▸ MAOA P21397 1/20 0.48
▸ KDM1A O60341 1/20 0.47
▸ HRH3 Q9Y5N1 4/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CHRM1 P11229 1/20 0.45
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL2471588 0.91 ALDH1A1 (0.55) ALDH1A1OPRL1OPRM1HRH3SIGMAR1
SCHEMBL2467207 0.91 CHRM5 (0.68) KCNH2OPRD1CHRM5CHRM3NPY1R
SCHEMBL2469571 0.88 CHRM5 (0.45) KCNH2OPRD1CHRM5CHRM3NPY1R
SCHEMBL14312347 0.86 ALDH1A1 (0.46) KCNH2OPRD1CHRM5CHRM3NPY1R
SCHEMBL2467926 0.86 GRIN2B (0.51) CHRM5CHRM3MAOAKDM1AHRH3
SCHEMBL2469942 0.83 KCNH2 (0.58) KCNH2OPRD1CHRM5CHRM3NPY1R
SCHEMBL2470147 0.82 HRH3 (0.46) CHRM5CHRM3HRH3SIGMAR1
SCHEMBL2474022 0.81 CHRM5 (0.61) KCNH2OPRD1CHRM5CHRM3NPY1R
SCHEMBL14312616 0.80 CHRM5 (0.60) KCNH2OPRD1CHRM5CHRM3NPY1R
SCHEMBL2469242 0.80 CHRM5 (0.60) KCNH2OPRD1CHRM5CHRM3NPY1R

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 KCNH2 2/4885OPRD1 2240/4885CHRM5 676/4885
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 KCNH2 2/4885OPRD1 2240/4885CHRM5 676/4885

“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.

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