SCHEMBL426108

SCHEMBL426108

CN(C(=O)n1cnc(-c2ccc(S(=O)(=O)N3CCC(O)CC3)cc2)c1)C1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.60
CES2 O00748 1/20 0.60
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
GFER P55789 1/20 0.46
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
USP2 O75604 1/20 0.44
HSD11B1 P28845 1/20 0.43
TP53 P04637 1/20 0.42
CNR2 P34972 1/20 0.40
PDE7A Q13946 1/20 0.40
HTT P42858 1/20 0.39
PKM P14618 1/20 0.39
EPHX2 P34913 1/20 0.38
NAMPT P43490 1/20 0.38

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
SCHEMBL428087 0.89 FAAH (0.59) FAAHCES2KMT2AMEN1GFER
SCHEMBL426096 0.84 FAAH (0.67) FAAHCES2KMT2AALDH1A1GAA
SCHEMBL427259 0.84 FAAH (0.53) FAAHCES2KMT2AMEN1GFER
SCHEMBL426004 0.83 FAAH (0.66) FAAHCES2KMT2AALDH1A1GAA
SCHEMBL427111 0.80 FAAH (0.61) FAAHCES2KMT2AMEN1ALDH1A1
SCHEMBL425914 0.80 FAAH (0.66) FAAHCES2KMT2AMEN1ALDH1A1
SCHEMBL14950289 0.80 FAAH (0.66) FAAHCES2TP53
SCHEMBL425056 0.79 FAAH (0.65) FAAHCES2ALDH1A1SMN1; SMN2TP53
SCHEMBL425807 0.79 FAAH (0.65) FAAHCES2KMT2AALDH1A1LMNA
SCHEMBL425811 0.79 FAAH (0.65) FAAHCES2KMT2AMEN1HSD11B1

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-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 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-20120065191-A1 PHARMACEUTICAL COMPOUNDS FAAH, FAAH2, ASAH1 FAAH 1/4885CES2 62/4885KMT2A 2067/4885

“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.