SCHEMBL4407150

SCHEMBL4407150

O=C(O)CCc1cccc(CC(=O)O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.63
PTPRB P23467 1/20 0.59
CDC25A P30304 1/20 0.59
CDC25B P30305 1/20 0.59
PTEN P60484 1/20 0.59
PTPMT1 Q8WUK0 1/20 0.59
FFAR1 O14842 5/20 0.59
AKR1B1 P15121 1/20 0.56
SELL P14151 1/20 0.50
SELP P16109 1/20 0.50
SELE P16581 1/20 0.50
TBXA2R P21731 1/20 0.49
HDAC3 O15379 1/20 0.48
MAPK1 P28482 1/20 0.48
ADRA1A P35348 1/20 0.48
HDAC4 P56524 1/20 0.48
SLC6A3 Q01959 1/20 0.48
HDAC1 Q13547 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48

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
SCHEMBL30638471 1.00 KEAP1 (0.63) KEAP1PTPRBCDC25ACDC25BPTEN
SCHEMBL70271 0.92 KEAP1 (0.74) KEAP1PTPRBCDC25ACDC25BPTEN
SCHEMBL4402323 0.90 AKR1B1 (0.62) KEAP1FFAR1AKR1B1SELLSELP
Hydrochloric Acid SCHEMBL10982620 0.90 KEAP1 (0.71) KEAP1PTPRBCDC25ACDC25BPTEN
SCHEMBL27780871 0.89 SMN1; SMN2 (0.66) KEAP1PTPRBCDC25ACDC25BPTEN
SCHEMBL70565 0.87 AKR1B1 (0.71) AKR1B1SELPSELECYP1A2CYP2C19
SCHEMBL27697776 0.87 KEAP1 (0.57) KEAP1PTPRBCDC25ACDC25BPTEN
SCHEMBL8435278 0.86 FFAR1 (0.80) KEAP1PTPRBCDC25ACDC25BPTEN
Hydrochloric Acid SCHEMBL8922940 0.85 AKR1B1 (0.68) AKR1B1SELPSELECYP1A2CYP2C19
SCHEMBL5968748 0.84 AKR1B1 (0.56) AKR1B1SELLSELPSELECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113549010-B Preparation and application of compound with AMPK (AMPK) agonistic activity and prodrug thereof 中国科学院上海药物研究所 2023-10-20 CN disclosed
US-9611273-B2 Trioxane thioacetal monomers and dimers and methods of use thereof THE JOHNS HOPKINS UNIVERSITY (US) 2017-04-04 US disclosed
US-7553809-B2 Fc receptor modulators and uses thereof ILEXUS PTY LIMITED (AU) 2009-06-30 US disclosed
US-20060057144-A1 Fc receptor modulators and uses thereof ILEXUS PTY LIMITED (AU) 2006-03-16 US disclosed
US-6835753-B2 Administering to the patient for inhibiting Fc receptor binding of immunoglobulin a compound selected from aromatic, heteroaromatic, cyclic, bicyclic and an amino acid derivative or salt ILEXUS PTY LIMITED (AU) 2004-12-28 US disclosed
US-20020061844-A1 Administering to the patient for inhibiting Fc receptor binding of immunoglobulin a compound selected from aromatic, heteroaromatic, cyclic, bicyclic and an amino acid derivative or salt ILEXUS PTY LIMITED 2002-05-23 US disclosed
US-6355683-B1 ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASE ILEXUS PTY LIMITED (AU) 2002-03-12 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 (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-20020061844-A1 Administering to the patient for inhibiting Fc receptor binding of immunoglobulin a compound selected from aromatic, heteroaromatic, cyclic, bicyclic and an amino acid derivative or salt FCGR2A, FCGR1A, FCER2 KEAP1 3859/4885PTPRB 212/4885CDC25A 3550/4885
US-20060057144-A1 Fc receptor modulators and uses thereof FCGR1A, FCER2, FCGR2A KEAP1 3715/4885PTPRB 85/4885CDC25A 3370/4885

“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.