Fumaric Acid

Fumaric Acid

SCHEMBL30424752

COc1ccc2c3c([nH]c2c1)CCN(C)CC3.O=C(O)/C=C/C(=O)O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

The experimentally established mechanism targets of Fumaric 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
DRD2 known ✓ P14416 2/20 0.53
MEN1 known ✓ O00255 1/20 0.43
HTR2A known ✓ P28223 1/20 0.43
HTR2C known ✓ P28335 1/20 0.43
KMT2A known ✓ Q03164 1/20 0.43
HTR7 P34969 2/20 0.53
ADRA2A P08913 1/20 0.53
ADRA2B P18089 1/20 0.53
ADRA2C P18825 1/20 0.53
NISCH Q9Y2I1 1/20 0.53
CYP1A2 P05177 3/20 0.53
CYP2D6 P10635 3/20 0.53
HSD17B10 Q99714 3/20 0.53
ALOX15 P16050 2/20 0.53
USP2 O75604 1/20 0.53
CYP2C9 P11712 1/20 0.53
DRD1 P21728 2/20 0.53
DRD5 P21918 2/20 0.53
DRD3 P35462 2/20 0.53
BAZ2B Q9UIF8 1/20 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
Fumaric Acid SCHEMBL25201865 1.00 HTR7 (0.53) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL29564708 0.89 CYP2D6 (0.64) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL25192385 0.89 CYP2D6 (0.64) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL25192202 0.81 CYP2D6 (0.53) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL25183522 0.81 HTR7 (0.56) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL18034945 0.80 CYP2D6 (0.62) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL28465408 0.78 BAZ2B (0.67) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL25190777 0.78 HTR7 (0.56) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL25634012 0.77 DRD2 (0.52) HTR7ADRA2AADRA2BADRA2CNISCH
SCHEMBL25774052 0.76 HTR7 (0.54) HTR7ADRA2AADRA2BADRA2CNISCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11905295-B2 Solid forms of tabernanthalog monofumarate salt for treating neurological disorders and/or psychiatric disorders TERRAN BIOSCIENCES INC. (US) 2024-02-20 US disclosed
US-20230279017-A1 SALT AND SOLID FORMS OF TABERNANTHALOG TERRAN BIOSCIENCES INC. 2023-09-07 US disclosed
US-20230257385-A1 SALT AND SOLID FORMS OF TABERNANTHALOG TERRAN BIOSCIENCES INC (US) 2023-08-17 US disclosed
WO-2023092045-A1 SALT AND SOLID FORMS OF TABERNANTHALOG TERRAN BIOSCIENCES, INC. (US) 2023-05-25 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-20230257385-A1 SALT AND SOLID FORMS OF TABERNANTHALOG SLC6A2, SLC6A4, SLC6A3 DRD2 2397/4885MEN1 2739/4885HTR2A 794/4885
US-20230279017-A1 SALT AND SOLID FORMS OF TABERNANTHALOG SLC6A2, SLC6A4, SLC6A3 DRD2 2397/4885MEN1 2739/4885HTR2A 794/4885
US-11905295-B2 Solid forms of tabernanthalog monofumarate salt for treating neurological disorders and/or psychiatric disorders FAH, SLC6A3, SLC6A2 DRD2 2293/4885MEN1 1569/4885HTR2A 736/4885

“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.