SCHEMBL1208677

SCHEMBL1208677

CC(C(=O)O)N(C(=O)OC(C)(C)C)c1ccc(Br)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 1/20 0.37
RECQL P46063 1/20 0.37
RAB9A P51151 1/20 0.37
AAK1 Q2M2I8 1/20 0.37
LDHA P00338 1/20 0.36
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
PRSS1 P07477 1/20 0.33
CTSG P08311 1/20 0.33
CTRB1 P17538 1/20 0.33
CMA1 P23946 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL9382586 0.86 SMN1; SMN2 (0.41) SMN1; SMN2RAB9AALDH1A1LMNAKMT2A
SCHEMBL2578175 0.86 SMN1; SMN2 (0.39) SMN1; SMN2NPC1RECQLRAB9AAAK1
SCHEMBL642839 0.86 SMN1; SMN2 (0.41) SMN1; SMN2RAB9AALDH1A1LMNAKMT2A
SCHEMBL6832851 0.85 USP30 (0.32) LMNAPRSS1CTSGCTRB1CMA1
SCHEMBL8364820 0.85 MT-CO2 (0.45) SMN1; SMN2LMNAKMT2AMEN1CYP2D6
SCHEMBL5846260 0.85 KMT2A (0.40) NPC1CTSSCTSKLMNAKMT2A
SCHEMBL2276227 0.85 MT-CO2 (0.45) SMN1; SMN2LMNAKMT2AMEN1CYP2D6
SCHEMBL10521312 0.85 NR1H2 (0.34) NPC1RAB9AAAK1ALDH1A1LMNA
SCHEMBL4648001 0.85 MT-CO2 (0.45) SMN1; SMN2LMNAKMT2AMEN1CYP2D6
SCHEMBL10431533 0.84 KEAP1 (0.42) SMN1; SMN2NPC1RAB9ALDHAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110046105-A1 Heterocycle-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising them and use thereof SANOFI-AVENTIS (FR) 2011-02-24 US disclosed
CN-1753673-B Prodrugs of GABA analogs, compositions and uses thereof XENOPORT INC 2010-09-29 CN disclosed
CN-1753673-A Prodrugs of gaba analogs, compositions and uses thereof XENOPORT INC (US) 2006-03-29 CN 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-20110046105-A1 Heterocycle-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising them and use thereof GIPR, DDC, PGC SMN1; SMN2 4621/4885NPC1 2432/4885RECQL 161/4885

“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.