Maleic Acid

Maleic Acid

SCHEMBL1944864

Cn1nnn(-c2cc(Nc3ncc(F)c(NC4CC(C)(C)NC(C)(C)C4)n3)c(F)cc2C2CC2)c1=O.O=C(O)/C=C\C(=O)O

nearest known ligand 0.35

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 11)

geneUniProtsupporting neighboursconfidence
EGFR known ✓ P00533 9/20 0.35
BTK known ✓ Q06187 6/20 0.35
AURKA O14965 1/20 0.35
AURKB Q96GD4 1/20 0.35
PRKCQ Q04759 1/20 0.34
CSNK2A2 P19784 1/20 0.34
CSNK2A1 P68400 1/20 0.34
ITK Q08881 3/20 0.33
ALK Q9UM73 6/20 0.32
BMX P51813 1/20 0.31
FLT3 P36888 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
Fumaric Acid SCHEMBL1944776 1.00 AURKA (0.35) AURKAAURKBEGFRBTKPRKCQ
Acetic Acid SCHEMBL1946734 0.95 AURKA (0.37) AURKAAURKBEGFRBTKPRKCQ
SCHEMBL1942477 0.94 PRKCQ (0.37) AURKAAURKBEGFRBTKPRKCQ
SCHEMBL1946599 0.92 PRKCQ (0.35) AURKAAURKBEGFRBTKPRKCQ
Sulfuric Acid SCHEMBL1944366 0.92 PRKCQ (0.35) AURKAAURKBEGFRBTKPRKCQ
Benzoic Acid SCHEMBL1945412 0.92 AURKA (0.39) AURKAAURKBEGFRBTKPRKCQ
Citric Acid SCHEMBL1945466 0.90 AURKA (0.34) AURKAAURKBEGFRBTKPRKCQ
SCHEMBL1942360 0.89 CSNK2A2 (0.36) AURKAAURKBEGFRBTKPRKCQ
SCHEMBL1942904 0.89 CSNK2A2 (0.36) AURKAAURKBEGFRBTKPRKCQ
SCHEMBL1944207 0.87 PRKCQ (0.35) AURKAAURKBEGFRBTKPRKCQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9732070-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
US-20170152246-A1 Protein Kinase C Inhibitors and Uses Thereof MIDCAP FINANCIAL TRUST 2017-06-01 US disclosed
EP-2507227-B1 TETRAZOLONES AS PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS INC (US) 2014-10-08 EP disclosed
EP-2507227-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF Rigel Pharmaceuticals, Inc. (US) 2012-10-10 EP disclosed
WO-2011068898-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS, INC. (US) 2011-06-09 WO disclosed
US-20110130415-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS, INC. 2011-06-02 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-20110130415-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF PRKCH, PRKCA, PRKCB EGFR 2299/4885BTK 248/4885AURKA 2000/4885
US-20170152246-A1 Protein Kinase C Inhibitors and Uses Thereof PRKCH, PRKCA, PRKCB EGFR 2299/4885BTK 248/4885AURKA 2000/4885

“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.