SCHEMBL3692879

SCHEMBL3692879

CCC(=O)NCC(O)CC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PSMB5 P28074 1/20 0.38
CYP2C9 P11712 1/20 0.37
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
POLB P06746 1/20 0.32
CNR2 P34972 1/20 0.31
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
ASAH1 Q13510 1/20 0.31

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
SCHEMBL15943619 0.84 MEN1 (0.44) MEN1KMT2APSMB5CYP2C9ALDH1A1
SCHEMBL9080368 0.84 MEN1 (0.44) MEN1KMT2APSMB5CYP2C9ALDH1A1
SCHEMBL12719510 0.84 MEN1 (0.44) MEN1KMT2APSMB5CYP2C9ALDH1A1
SCHEMBL12379986 0.84 ALDH1A1 (0.33) USP2TSHRALDH1A1LMNAHTT
SCHEMBL18908557 0.82 MEN1 (0.43) MEN1KMT2APSMB5CYP2C9TSHR
SCHEMBL21901280 0.82 MEN1 (0.43) MEN1KMT2APSMB5CYP2C9TSHR
SCHEMBL11284773 0.82 ALDH1A1 (0.43) MEN1KMT2ACYP2C9USP2TSHR
SCHEMBL22519382 0.81 MEN1 (0.39) MEN1KMT2APSMB5CYP2C9
SCHEMBL19343056 0.80 HPGD (0.43) KMT2APSMB5ALDH1A1HTTCYP2D6
SCHEMBL17208748 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114917763-A Method for preparing hydrophilic PES ultrafiltration membrane by in-situ polymerization of water-soluble monomer 浙江理工大学 2022-08-19 CN claimed
CN-114917763-A Method for preparing hydrophilic PES ultrafiltration membrane by in-situ polymerization of water-soluble monomer 浙江理工大学 2022-08-19 CN disclosed
CN-114917763-A Method for preparing hydrophilic PES ultrafiltration membrane by in-situ polymerization of water-soluble monomer 浙江理工大学 2022-08-19 CN disclosed
US-20130123239-A1 COMPOUNDS HAVING TRPV1 ANTAGONISTIC ACTIVITY AND USES THEREOF PURDUE PHARMA L.P. 2013-05-16 US disclosed
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
EP-1597248-B1 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS LILLY CO ELI (US) 2007-12-26 EP disclosed
US-20060217433-A1 Sulfonamide derivatives as ppar modulators ELI LILLY AND COMPANY (US) 2006-09-28 US disclosed
EP-1597248-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-11-23 EP disclosed
WO-2004073606-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-09-02 WO disclosed
EP-0790252-A1 FUMARIC ACID DERIVATIVE AND POLYMER THEREOF NOF CORPORATION (JP) 1997-08-20 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 (2 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-20060217433-A1 Sulfonamide derivatives as ppar modulators PPARD, PPARA, PPARG MEN1 4858/4885KMT2A 2003/4885PSMB5 2345/4885
US-20130123239-A1 COMPOUNDS HAVING TRPV1 ANTAGONISTIC ACTIVITY AND USES THEREOF TRPV1, TRPA1, TRPV2 MEN1 4737/4885KMT2A 4676/4885PSMB5 1069/4885

“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.