Valproic Acid

Valproic Acid

SCHEMBL3896315

CCCC(CCC)C(=O)O.[LiH]

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ALDH5A1

The experimentally established mechanism targets of Valproic 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
▸ CHRM1 P11229 1/20 0.94
▸ AKR1A1 P14550 1/20 0.94
▸ CHRM3 P20309 1/20 0.94
▸ HTR2A P28223 1/20 0.94
▸ HTR2C P28335 1/20 0.94
▸ ADRA1A P35348 1/20 0.94
▸ HRH1 P35367 1/20 0.94
▸ DRD3 P35462 1/20 0.94
▸ SLC6A3 Q01959 1/20 0.94
▸ HDAC1 Q13547 1/20 0.94
▸ HDAC2 Q92769 1/20 0.94
▸ TDP1 Q9NUW8 1/20 0.94
▸ SLC1A2 P43004 4/20 0.60
▸ SLC1A1 P43005 4/20 0.60
▸ GRIK1 P39086 4/20 0.60
▸ GRIK2 Q13002 4/20 0.60
▸ SLC1A3 P43003 3/20 0.60
▸ CYP3A4 P08684 2/20 0.55
▸ TSHR P16473 2/20 0.55
▸ NFKB1 P19838 2/20 0.55

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
Valproic Acid SCHEMBL140241 0.97 CHRM1 (1.00) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL2275 0.97 CHRM1 (1.00) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL1330837 0.97 CHRM1 (1.00) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL1311803 0.94 CHRM1 (0.94) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL476077 0.94 CHRM1 (0.94) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL2054191 0.94 CHRM1 (0.94) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL1702790 0.94 CHRM1 (0.94) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL2184648 0.94 CHRM1 (0.94) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL1000813 0.94 CHRM1 (0.94) CHRM1AKR1A1CHRM3HTR2AHTR2C
Valproic Acid SCHEMBL21378840 0.94 CHRM1 (0.94) CHRM1AKR1A1CHRM3HTR2AHTR2C

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 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1697649-B Dosage form and method for producing the same ROEHM GMBH 2010-05-12 — — CN claimed
CN-1697649-A Dosage form and method for producing the same ROEHM GMBH (DE) 2005-11-16 — — CN claimed
US-12364261-B2 Liquid sulfonylurea- and Li-salt containing herbicidal compositions BATTELLE UK LIMITED (GB) 2025-07-22 — — US disclosed
EP-4138556-B1 LIQUID SULFONYLUREA HERBICIDE COMPOSITION BATTELLE UK LTD (GB) 2023-12-27 — — EP disclosed
US-20230165255-A1 LIQUID SULFONYLUREA HERBICIDE COMPOSITION MITSUI AGRISCIENCE INTERNATIONAL S.A./N.V. (BE) 2023-06-01 — — US disclosed
EP-4138556-A1 LIQUID SULFONYLUREA HERBICIDE COMPOSITION Battelle UK Limited (GB) 2023-03-01 — — EP disclosed
US-20220378040-A1 LIQUID SULFONYLUREA- AND LI-SALT CONTAINING HERBICIDAL COMPOSITIONS MITSUI AGRISCIENCE INTERNATIONAL S.A./N.V. (IE) 2022-12-01 — — US disclosed
US-11464225-B2 Liquid sulfonylurea- and li-salt containing herbicidal compositions BATTELLE UK LIMITED (GB) 2022-10-11 — — US disclosed
WO-2021214316-A1 LIQUID SULFONYLUREA HERBICIDE COMPOSITION BATTELLE UK LIMITED (GB) 2021-10-28 — — WO disclosed
EP-3900535-A1 LIQUID SULFONYLUREA HERBICIDE COMPOSITION Battelle UK Limited (GB) 2021-10-27 — — EP disclosed
CN-105636961-B piperazine derivatives and their use as medicaments 勃林格殷格翰国际有限公司 2019-11-05 — — CN disclosed
CN-1208319-C 2-oxo-1-pyrrolidine derivatives, preparation method and use thereof UCB SA (BE) 2005-06-29 — — CN disclosed
US-20050044778-A1 Fuel compositions employing catalyst combustion structure OCTANE INTERNATIONAL, LTD. 2005-03-03 — — US disclosed
US-20040237384-A1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2004-12-02 — — US disclosed
US-6652608-B1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2003-11-25 — — US disclosed
CN-1404469-A 2-oxo-1-pyrrolidine derivatives, preparation method and use thereof UCB SA (BE) 2003-03-19 — — CN disclosed
EP-1051461-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR, William C. (US) 2000-11-15 — — EP disclosed
WO-1999066009-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR WILLIAM C (US) 1999-12-23 — — WO disclosed
EP-0954558-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR, William C. (US) 1999-11-10 — — EP disclosed
WO-1998026028-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 1998-06-18 — — 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 (4 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-12364261-B2 Liquid sulfonylurea- and Li-salt containing herbicidal compositions LCT, CLIC1, CLIC4 CHRM1 1095/4885AKR1A1 2462/4885CHRM3 1279/4885
US-11464225-B2 Liquid sulfonylurea- and li-salt containing herbicidal compositions LCT, CLIC1, CLIC4 CHRM1 1095/4885AKR1A1 2462/4885CHRM3 1279/4885
US-20220378040-A1 LIQUID SULFONYLUREA- AND LI-SALT CONTAINING HERBICIDAL COMPOSITIONS LCT, CLIC1, CLIC4 CHRM1 1095/4885AKR1A1 2462/4885CHRM3 1279/4885
US-20230165255-A1 LIQUID SULFONYLUREA HERBICIDE COMPOSITION ABCC4, PTPN21, SALL4 CHRM1 1887/4885AKR1A1 2519/4885CHRM3 1513/4885

“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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