SCHEMBL2702185

SCHEMBL2702185

CN(C)S(=O)(=O)N1CCC(C(N)=O)(c2ccccc2)CC1

nearest known ligand 0.82

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 1/20 0.56
KMT2A Q03164 4/20 0.52
ALDH1A1 P00352 5/20 0.50
CYP2C19 P33261 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
OPRL1 P41146 1/20 0.50
HSD11B1 P28845 1/20 0.48
MEN1 O00255 3/20 0.46
RAB9A P51151 1/20 0.46
GAA P10253 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 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
SCHEMBL2701832 0.85 KMT2A (0.57) SMN1; SMN2TSHRKMT2AALDH1A1CYP2C19
SCHEMBL2701654 0.82 OPRL1 (0.55) SMN1; SMN2TSHRKMT2AALDH1A1CYP2C19
SCHEMBL2702235 0.81 ALDH1A1 (0.39) SMN1; SMN2TSHRKMT2AALDH1A1MEN1
SCHEMBL2470399 0.80 ALDH1A1 (0.71) SMN1; SMN2TSHRKMT2AALDH1A1OPRL1
SCHEMBL2701656 0.80 GAA (0.53) SMN1; SMN2TSHRKMT2AALDH1A1CYP2C19
SCHEMBL2700042 0.79 KMT2A (0.54) SMN1; SMN2TSHRKMT2AALDH1A1CYP2C19
SCHEMBL12227090 0.79 OPRM1 (0.61) OPRL1HSD11B1
SCHEMBL8366154 0.78 OPRL1 (0.56) SMN1; SMN2TSHRKMT2AALDH1A1OPRL1
SCHEMBL2702188 0.77 MAOA (0.53) SMN1; SMN2TSHRKMT2AALDH1A1L3MBTL1
SCHEMBL7975314 0.76 HSD11B1 (0.55) KMT2AALDH1A1CYP2C19OPRL1HSD11B1

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 5 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-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 4032/4885TSHR 2555/4885KMT2A 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.