Maleic Acid

Maleic Acid

SCHEMBL2119082

CC(C)C1=CC2=CCC3[C@](C)(C(=O)OCC(O)CO)CCC[C@]3(C)[C@H]2CC1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.64

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
▸ HSD17B10 Q99714 3/20 0.64
▸ ALOX15 P16050 3/20 0.64
▸ PDK1 Q15118 2/20 0.64
▸ PDK2 Q15119 2/20 0.64
▸ PDK3 Q15120 2/20 0.64
▸ PDK4 Q16654 2/20 0.64
▸ LMNA P02545 2/20 0.64
▸ ALDH1A1 P00352 2/20 0.64
▸ CYP3A4 P08684 2/20 0.64
▸ MAPT P10636 2/20 0.64
▸ CYP2C9 P11712 2/20 0.64
▸ CYP2C19 P33261 2/20 0.64
▸ SLCO1B3 Q9NPD5 1/20 0.64
▸ SLCO1B1 Q9Y6L6 1/20 0.64
▸ GABRA1 P14867 1/20 0.64
▸ GABRB2 P47870 1/20 0.64
▸ KDM4E B2RXH2 1/20 0.64
▸ MAPK1 P28482 2/20 0.55
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49

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
SCHEMBL29363132 0.95 HSD17B10 (0.67) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL15137271 0.95 HSD17B10 (0.67) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL31152669 0.95 HSD17B10 (0.67) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL15072078 0.95 HSD17B10 (0.67) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL123110 0.95 HSD17B10 (0.67) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL15072071 0.88 HSD17B10 (0.67) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL15076162 0.87 HSD17B10 (0.66) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL24412724 0.86 HSD17B10 (0.65) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL13454791 0.86 HSD17B10 (0.65) HSD17B10ALOX15PDK1PDK2PDK3
SCHEMBL17014612 0.85 HSD17B10 (0.64) HSD17B10ALOX15PDK1PDK2PDK3

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
US-20120093896-A1 USE OF NANODISPERSIONS TO PROTECT WATER-SOLUBLE INGREDIENTS IN COSMETIC END FORMULATIONS CIBA CORPORATION (US) 2012-04-19 — — US disclosed
US-20100111884-A1 UV ABSORBER FORMULATIONS CIBA CORPORATION (US) 2010-05-06 — — US disclosed
EP-2170250-A1 USE OF NANODISPERSIONS TO PROTECT WATER-SOLUBLE INGREDIENTS IN COSMETIC END FORMULATIONS BASF SE (DE) 2010-04-07 — — EP disclosed
EP-2099530-A1 UV ABSORBER FORMULATIONS Ciba Holding Inc. (CH) 2009-09-16 — — EP disclosed
US-20090196894-A1 Self Tanning Composition CIBA CORP. 2009-08-06 — — US disclosed
WO-2009016064-A1 USE OF NANODISPERSIONS TO PROTECT WATER-SOLUBLE INGREDIENTS IN COSMETIC END FORMULATIONS BASF SE (CH) 2009-02-05 — — WO disclosed
WO-2008080892-A1 UV ABSORBER FORMULATIONS CIBA HOLDING INC. (CH) 2008-07-10 — — 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 (3 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-20100111884-A1 UV ABSORBER FORMULATIONS C1R, C1S, C9 HSD17B10 1028/4885ALOX15 1518/4885PDK1 3479/4885
US-20090196894-A1 Self Tanning Composition C9, KRT18, F12 HSD17B10 2267/4885ALOX15 2314/4885PDK1 797/4885
US-20120093896-A1 USE OF NANODISPERSIONS TO PROTECT WATER-SOLUBLE INGREDIENTS IN COSMETIC END FORMULATIONS CUTA, PROC, RBP1 HSD17B10 929/4885ALOX15 344/4885PDK1 864/4885

“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.

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