SCHEMBL2858838

SCHEMBL2858838

O=C(N1CCN(c2ccccc2)CC1)C1(c2ccccc2)CCCCC1

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.75
KMT2A Q03164 2/20 0.75
SMN1; SMN2 Q16637 1/20 0.72
HSD11B1 P28845 6/20 0.68
ALDH1A1 P00352 4/20 0.63
LMNA P02545 3/20 0.63
TSHR P16473 3/20 0.63
NPSR1 Q6W5P4 1/20 0.63
SIGMAR1 Q99720 1/20 0.56
HDAC4 P56524 2/20 0.53
AKR1C1 Q04828 1/20 0.51
USP2 O75604 1/20 0.50

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
SCHEMBL6896465 0.86 MEN1 (1.00) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL2471436 0.86 HSD11B1 (0.57) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL2472088 0.84 HSD11B1 (0.54) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL18390061 0.84 MEN1 (0.77) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL21733046 0.84 MEN1 (0.77) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL7168690 0.83 HSD11B1 (0.62) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL16507207 0.83 MEN1 (0.93) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL20962625 0.82 MEN1 (0.74) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL18390860 0.82 MEN1 (0.74) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1
SCHEMBL11085490 0.81 MEN1 (0.77) MEN1KMT2ASMN1; SMN2HSD11B1ALDH1A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2253328-A1 Cycloalkyl inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2010-11-24 EP disclosed
EP-2253328-A1 Cycloalkyl inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2010-11-24 EP disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-20050234106-A1 Cycloalkyl inhibitors of potassium channel function LLOYD JOHN 2005-10-20 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-20050234106-A1 Cycloalkyl inhibitors of potassium channel function KCNJ2, KCNN3, KCNQ5 MEN1 4430/4885KMT2A 1396/4885SMN1; SMN2 4281/4885
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNN3, KCNQ5 MEN1 4430/4885KMT2A 1396/4885SMN1; SMN2 4281/4885

“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.