Fumaric Acid

Fumaric Acid

SCHEMBL10519985

Nc1nc(-c2ccc(CN3CCCCC3)s2)cs1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.48

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
▸ MEN1 known ✓ O00255 2/20 0.48
▸ KMT2A known ✓ Q03164 2/20 0.48
▸ ALDH1A1 P00352 5/20 0.48
▸ MAPT P10636 4/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ TBK1 Q9UHD2 5/20 0.47
▸ IKBKE Q14164 4/20 0.47
▸ HTT P42858 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ GFER P55789 1/20 0.39
▸ HRH3 Q9Y5N1 2/20 0.38
▸ HRH4 Q9H3N8 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ GMNN O75496 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ PMP22 Q01453 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.36

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 SCHEMBL10519990 1.00 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EHSD17B10MEN1
SCHEMBL10520041 0.89 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EHSD17B10MEN1
Fumaric Acid SCHEMBL10520381 0.89 ALDH1A1 (0.46) ALDH1A1MAPTKDM4EHSD17B10MEN1
Maleic Acid SCHEMBL10520379 0.89 ALDH1A1 (0.46) ALDH1A1MAPTKDM4EHSD17B10MEN1
SCHEMBL10518389 0.78 SMN1; SMN2 (0.61) ALDH1A1MAPTKDM4EHSD17B10MEN1
SCHEMBL10517171 0.77 HSD17B10 (0.46) ALDH1A1MAPTKDM4EHSD17B10MEN1
Fumaric Acid SCHEMBL10517651 0.76 ALDH1A1 (0.61) ALDH1A1MAPTKDM4EHSD17B10MEN1
Maleic Acid SCHEMBL10517643 0.76 ALDH1A1 (0.61) ALDH1A1MAPTKDM4EHSD17B10MEN1
Fumaric Acid SCHEMBL10520700 0.74 ALDH1A1 (0.53) ALDH1A1MAPTKDM4EHSD17B10MEN1
Fumaric Acid SCHEMBL10520711 0.74 ALDH1A1 (0.53) ALDH1A1MAPTKDM4EHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0183191-B1 THIENYLTHIAZOLE COMPOUNDS Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1989-05-10 — — EP disclosed
US-4720493-A Thienylthiazole compounds YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1988-01-19 — — US disclosed
EP-0183191-A1 Thienylthiazole compounds Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1986-06-04 — — EP disclosed
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