SCHEMBL1448003

SCHEMBL1448003

Cc1c(O)cccc1/C=C1/SC(=S)N(CC(=O)O)C1=O

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.58
▸ KMT2A Q03164 4/20 0.58
▸ MAPT P10636 3/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ POLB P06746 1/20 0.58
▸ HPGD P15428 1/20 0.58
▸ PSMD14 O00487 1/20 0.58
▸ PKM P14618 1/20 0.58
▸ GFER P55789 1/20 0.58
▸ NSD2 O96028 1/20 0.57
▸ HSP90AA1 P07900 1/20 0.57
▸ APOBEC3G Q9HC16 1/20 0.57
▸ AKR1B1 P15121 1/20 0.57
▸ PTPN12 Q05209 1/20 0.56
▸ PTPN22 Q9Y2R2 1/20 0.56

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
SCHEMBL18102937 0.88 MEN1 (0.73) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL17319259 0.83 AKR1B1 (0.59) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL18095861 0.81 CTNNB1 (0.65) MEN1KMT2APOLBAKR1B1
SCHEMBL18102989 0.81 CTNNB1 (0.65) MEN1KMT2APOLBAKR1B1
SCHEMBL18095863 0.81 CTNNB1 (0.65) MEN1KMT2APOLBAKR1B1
SCHEMBL10492194 0.81 MMP3 (0.62) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL10492197 0.81 MMP3 (0.62) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL10492272 0.80 AKR1B1 (0.78) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL20558928 0.80 KMT2A (0.62) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL20558930 0.80 KMT2A (0.62) MEN1KMT2AMAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110144170-A1 Fc RECEPTOR MODULATING COMPOUNDS AND COMPOSITIONS THE MACFARLANE BURNET INSTITUTE FOR MEDICAL RESEARCH AND PUBLIC HEALTH LTD (AU) 2011-06-16 — — US disclosed
US-7910770-B2 3-Isopropoxy-7-methoxy-N-(1H-1,2,3,4-tetrazol-5-yl)-1-benzo[b]thiophene-2-carboxamide; autoimmune diseases such as rheumatoid arthritis, immune thrombocytopenia purpura, systemic lupus erythematosus and Crohn's disease TRILLIUM THERAPEUTICS INC. (CA) 2011-03-22 — — US disclosed
EP-1585745-A4 FC RECEPTOR MODULATING COMPOUNDS AND COMPOSITIONS TRILLIUM THERAPEUTICS INC (CA) 2008-07-09 — — EP disclosed
US-20080146632-A1 Fc Receptor Modulating Compounds and Compositions TRILLIUM THERAPEUTICS, INC. (CA) 2008-06-19 — — US disclosed
US-7332631-B2 These compounds typically have a core lipophilic group, substituted with a group rich in pi -electrons, preferably having a delocalised pi -electron system; typically include at least one acidic group having a pi -electron system; Autoimmune diseases TRILLIUM THERAPEUTICS INC. (CA) 2008-02-19 — — US disclosed
US-20060264484-A1 Fc receptor modulating compounds and compositions THE MACFARLANE BURNET INSTITUTE FOR MEDICAL RESEARCH AND PUBLIC HEALTH LTD (AU) 2006-11-23 — — US disclosed
EP-1585745-A1 FC RECEPTOR MODULATING COMPOUNDS AND COMPOSITIONS Arthron Limited (AU) 2005-10-19 — — EP disclosed
WO-2004058747-A1 FC RECEPTOR MODULATING COMPOUNDS AND COMPOSITIONS ARTHRON LIMITED (AU) 2004-07-15 — — WO 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 (3 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-20110144170-A1 Fc RECEPTOR MODULATING COMPOUNDS AND COMPOSITIONS FCGR1A, FCGR2A, FCGR3B MEN1 3865/4885KMT2A 3373/4885MAPT 4834/4885
US-20080146632-A1 Fc Receptor Modulating Compounds and Compositions FCGR1A, FCGR2A, FCGR3B MEN1 3865/4885KMT2A 3373/4885MAPT 4834/4885
US-20060264484-A1 Fc receptor modulating compounds and compositions FCGR1A, FCGR2A, FCGR3B MEN1 3943/4885KMT2A 3966/4885MAPT 4846/4885

“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.

Send feedback