Maleic Acid

Maleic Acid

SCHEMBL6790541

Clc1ccc(-c2cccc3c2[C@@H]2CCNCC[C@H]2N3)c(Cl)c1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.41

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 3/20 0.41
SLC6A4 known ✓ P31645 3/20 0.41
SLC6A3 known ✓ Q01959 2/20 0.41
HRH1 known ✓ P35367 2/20 0.38
HTR2A known ✓ P28223 1/20 0.34
HTR2C known ✓ P28335 1/20 0.34
HRH4 Q9H3N8 1/20 0.36
CHRM1 P11229 8/20 0.35
CHRM3 P20309 3/20 0.35
MAPK1 P28482 2/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
GAA P10253 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
CYP2C19 P33261 1/20 0.34

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 SCHEMBL6790544 1.00 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3HRH1HRH4
Maleic Acid SCHEMBL6790540 1.00 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3HRH1HRH4
Fumaric Acid SCHEMBL6782504 0.82 HRH1 (0.39) SLC6A2SLC6A4SLC6A3HRH1CHRM1
Maleic Acid SCHEMBL6782500 0.82 HRH1 (0.39) SLC6A2SLC6A4SLC6A3HRH1CHRM1
Maleic Acid SCHEMBL6782497 0.82 HRH1 (0.39) SLC6A2SLC6A4SLC6A3HRH1CHRM1
SCHEMBL6787167 0.81 CHRM1 (0.43) SLC6A2SLC6A4CHRM1CHRM3MAPK1
SCHEMBL6787169 0.81 CHRM1 (0.43) SLC6A2SLC6A4CHRM1CHRM3MAPK1
SCHEMBL6785400 0.79 HTR2C (0.36) SLC6A2SLC6A4SLC6A3CHRM1KMT2A
SCHEMBL6786098 0.79 CHRM1 (0.35) SLC6A2SLC6A4SLC6A3CHRM1CHRM3
SCHEMBL6785401 0.79 HTR2C (0.36) SLC6A2SLC6A4SLC6A3CHRM1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6828314-B2 Modulation of the activity of serotonin receptors (5-HT) to treat diseases such as anxiety, depression or obesity PFIZER 2004-12-07 US disclosed
US-20030225058-A1 Substituted azepino[4,5b]indoline derivatives PHARMACIA & UPJOHN COMPANY 2003-12-04 US disclosed
US-6586421-B2 For therapy of central nervous system, including diseases, disorders, and conditions related to, such as anxiety, depression, hypertension, migraine, obesity, compulsive disorders, schizophrenia, autism, neurodegenerative disorders PHARMACIA & UPJOHN COMPANY 2003-07-01 US disclosed
EP-1319005-A2 SUBSTITUTED AZEPINO[4,5-B]INDOLINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-06-18 EP disclosed
WO-2002024700-A2 SUBSTITUTED AZEPINO[4,5b]INDOLINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2002-03-28 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 (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-20030225058-A1 Substituted azepino[4,5b]indoline derivatives HTR5A, HTR1A, HTR4 SLC6A2 104/4885SLC6A4 21/4885SLC6A3 69/4885

“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.