SCHEMBL2473435

SCHEMBL2473435

CCCC(=O)N1CCC(C(=O)NCCCc2ccccc2)(c2ccccc2)CC1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.53
CHRM3 P20309 1/20 0.53
EPHX2 P34913 2/20 0.47
KCNA3 P22001 1/20 0.47
NAMPT P43490 2/20 0.46
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
OPRL1 P41146 3/20 0.45
ALDH1A1 P00352 2/20 0.45
OPRM1 P35372 2/20 0.45
SIGMAR1 Q99720 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
EPHX1 P07099 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
SCHEMBL12194770 0.87 GFER (0.53) CHRM5CHRM3EPHX2NAMPTOPRL1
SCHEMBL2472256 0.86 ALDH1A1 (0.60) CHRM5CHRM3OPRL1ALDH1A1OPRM1
SCHEMBL2465417 0.86 CHRM5 (0.49) CHRM5CHRM3HTTSMN1; SMN2OPRL1
SCHEMBL13593900 0.85 CHRM5 (0.74) CHRM5CHRM3ALDH1A1
SCHEMBL13688315 0.85 CHRM5 (0.60) CHRM5CHRM3EPHX2HTTSMN1; SMN2
SCHEMBL2472932 0.85 MC4R (0.48) CHRM5CHRM3EPHX2
SCHEMBL2469501 0.85 LMNA (0.48) CHRM5CHRM3EPHX2HTTSMN1; SMN2
SCHEMBL2471830 0.85 PLAAT3 (0.47) CHRM5CHRM3EPHX2NAMPTHTT
SCHEMBL10255025 0.85 CHRM5 (0.48) CHRM5CHRM3EPHX2KCNA3NAMPT
SCHEMBL2471157 0.84 GFER (0.52) CHRM5CHRM3EPHX2NAMPTOPRL1

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-2371366-A1 Heterocyclo inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2011-10-05 EP disclosed
EP-2371366-A1 Heterocyclo inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2011-10-05 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-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

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 CHRM5 676/4885CHRM3 1015/4885EPHX2 3772/4885

“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.