SCHEMBL291950

SCHEMBL291950

CCCC(C)NS([NH])(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.48
CA12 O43570 3/20 0.47
CA2 P00918 3/20 0.47
CA9 Q16790 1/20 0.47
ALDH1A1 P00352 3/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CA1 P00915 2/20 0.31
CA7 P43166 2/20 0.31
CA14 Q9ULX7 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HPGD P15428 1/20 0.31
POLB P06746 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL291880 0.86 ADH1B (0.39) SMN1; SMN2CA12CA2CA9ALDH1A1
SCHEMBL8745616 0.83 ADH1B (0.50) SMN1; SMN2CA2CA1TP53
SCHEMBL5254185 0.80 SMN1; SMN2 (0.52) SMN1; SMN2CA12CA2CA9ALDH1A1
SCHEMBL43072 0.80
SCHEMBL15218404 0.78 SMN1; SMN2 (0.50) SMN1; SMN2CA12CA2CA9ALDH1A1
SCHEMBL1726872 0.76 SMN1; SMN2 (0.48) SMN1; SMN2CA12CA2CA9ALDH1A1
SCHEMBL291951 0.76 SMN1; SMN2 (0.48) SMN1; SMN2CA12CA2CA9ALDH1A1
SCHEMBL292581 0.74 TAS1R3 (0.33) SMN1; SMN2CA12CA2CA9LMNA
SCHEMBL27182951 0.74 CA2 (0.50) SMN1; SMN2CA12CA2CA9ALDH1A1
SCHEMBL25097359 0.73 SMN1; SMN2 (0.46) SMN1; SMN2CA12CA2CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158790-B2 Cyclic amine compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-04-17 US disclosed
EP-2036896-B1 CYCLIC AMINE COMPOUND DAIICHI SANKYO CO LTD (JP) 2012-03-14 EP disclosed
US-20090286807-A1 CYCLIC AMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-11-19 US disclosed
EP-2036896-A1 CYCLIC AMINE COMPOUND Daiichi Sankyo Company, Limited (JP) 2009-03-18 EP 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-20090286807-A1 CYCLIC AMINE COMPOUND HRH3, HRH4, H1-0 SMN1; SMN2 4464/4885CA12 4320/4885CA2 2321/4885

“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.