Maleic Acid

Maleic Acid

SCHEMBL16458332

CN1CCN(CCC2=CCc3c2cccc3-c2ccc(F)cc2)CC1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol

The experimentally established mechanism targets of Maleic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 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
Fumaric Acid SCHEMBL15544885 1.00 KDM4E (0.42) KDM4EALDH1A1POLBTSHRSMN1; SMN2
Maleic Acid SCHEMBL16457674 0.91 ALDH1A1 (0.47) KDM4EALDH1A1POLBSMN1; SMN2
Fumaric Acid SCHEMBL15544596 0.91 ALDH1A1 (0.47) KDM4EALDH1A1POLBSMN1; SMN2
Fumaric Acid SCHEMBL15544522 0.91 KDM4E (0.42) KDM4EALDH1A1POLBSMN1; SMN2
Maleic Acid SCHEMBL16457848 0.91 KDM4E (0.42) KDM4EALDH1A1POLBSMN1; SMN2
SCHEMBL15591747 0.90 ALDH1A1 (0.40) KDM4EALDH1A1POLBTSHR
Fumaric Acid SCHEMBL15543696 0.90 ALDH1A1 (0.42) KDM4EALDH1A1POLBSMN1; SMN2
Maleic Acid SCHEMBL16458107 0.90 ALDH1A1 (0.42) KDM4EALDH1A1POLBSMN1; SMN2
Fumaric Acid SCHEMBL15545601 0.89 HTR1A (0.45) ALDH1A1POLB
Maleic Acid SCHEMBL16457833 0.89 HTR1A (0.45) ALDH1A1POLB

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-9493434-B2 Substituted indenes as medicaments LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2016-11-15 US claimed
EP-2870145-B1 INDENE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE LABOR DR (ES) 2016-09-21 EP claimed
US-20150158831-A1 INDENE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE PHARMACEUTICALS, S.A. (ES) 2015-06-11 US claimed
EP-2682391-A1 Indene derivatives, their preparation and use as medicaments Laboratorios Del. Dr. Esteve, S.A. (ES) 2014-01-08 EP claimed
US-9493434-B2 Substituted indenes as medicaments LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2016-11-15 US disclosed
EP-2870145-B1 INDENE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE LABOR DR (ES) 2016-09-21 EP disclosed
US-20150158831-A1 INDENE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE PHARMACEUTICALS, S.A. (ES) 2015-06-11 US disclosed
EP-2682391-A1 Indene derivatives, their preparation and use as medicaments Laboratorios Del. Dr. Esteve, S.A. (ES) 2014-01-08 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 (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-20150158831-A1 INDENE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICAMENTS SIGMAR1, TMEM97, OPRK1 KDM4E 4516/4885ALDH1A1 1321/4885POLB 3114/4885

“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.