SCHEMBL20456972

SCHEMBL20456972

CCN(CC)C(=O)C1CCCN(S(=O)(=O)c2cccc(Cl)c2C)C1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.65
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 4/20 0.51
HTT P42858 2/20 0.51
RAB9A P51151 2/20 0.47
CYP2C19 P33261 1/20 0.47
HPGD P15428 1/20 0.46
TP53 P04637 2/20 0.46
MAPT P10636 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NPC1 O15118 1/20 0.45
NR2F2 P24468 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL5243753 0.84 HSD11B1 (0.72) HSD11B1TP53MAPTKMT2APOLB
SCHEMBL609816 0.81 HSD11B1 (0.57) HSD11B1ALDH1A1HTTRAB9ATP53
SCHEMBL609817 0.81 HSD11B1 (0.57) HSD11B1ALDH1A1HTTRAB9ATP53
SCHEMBL4960486 0.81 HSD11B1 (0.57) HSD11B1ALDH1A1HTTRAB9ATP53
SCHEMBL5250238 0.80 MEN1 (0.60) KDM4EALDH1A1HTTRAB9ACYP2C19
SCHEMBL5247343 0.80 HSD11B1 (0.70) HSD11B1HTTTP53MAPTMEN1
SCHEMBL611305 0.80 HSD11B1 (0.98) HSD11B1ALDH1A1RAB9AMEN1KMT2A
SCHEMBL4142798 0.80 HSD11B1 (0.90) HSD11B1ALDH1A1RAB9ATP53MAPT
SCHEMBL4962053 0.80 HSD11B1 (0.98) HSD11B1ALDH1A1RAB9AMEN1KMT2A
SCHEMBL6488610 0.80 HSD11B1 (0.69) HSD11B1KDM4EALDH1A1HTTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10039772-B2 Methods and compositions for treating alcohol use disorders SANNA PIETRO PAOLO (US) 2018-08-07 US disclosed
US-10039772-B2 Methods and compositions for treating alcohol use disorders SANNA PIETRO PAOLO (US) 2018-08-07 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-10039772-B2 Methods and compositions for treating alcohol use disorders HSD3B1, HSD11B1, HSD3B2 HSD11B1 2/4885KDM4E 3167/4885ALDH1A1 122/4885

“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.