Butyric Acid

Butyric Acid

SCHEMBL21145312

CC1(C)COCN1.CCCC(=O)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
AKR1B1 P15121 1/20 0.33
GPR84 Q9NQS5 7/20 0.32
PPARG P37231 7/20 0.32
PPARD Q03181 7/20 0.32
PPARA Q07869 7/20 0.32
HDAC11 Q96DB2 5/20 0.32
TSHR P16473 4/20 0.32
PTPN1 P18031 3/20 0.32
ALDH1A1 P00352 2/20 0.32
TLR2 O60603 2/20 0.32
TDP1 Q9NUW8 2/20 0.32

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
Valeric Acid SCHEMBL21145200 0.90 AKR1B1 (0.44) CYP1A2CYP2D6CYP2C9CYP2C19AKR1B1
Hexanoate SCHEMBL21145271 0.88 AKR1B1 (0.52) CYP1A2CYP2C9CYP2C19AKR1B1GPR84
Propionic Acid SCHEMBL21145090 0.87 CYP1A2 (0.43) FFAR3CYP1A2CYP2D6CYP2C9CYP2C19
Octanoic Acid SCHEMBL21145046 0.87 GPR84 (0.53) CYP1A2CYP2C9CYP2C19AKR1B1GPR84
Decanoic Acid SCHEMBL21145324 0.87 GPR84 (0.53) CYP1A2CYP2C9CYP2C19AKR1B1GPR84
Nonanoate SCHEMBL21145042 0.87 GPR84 (0.53) CYP1A2CYP2C9CYP2C19AKR1B1GPR84
Undecanoate SCHEMBL21145184 0.87 GPR84 (0.53) CYP1A2CYP2C9CYP2C19AKR1B1GPR84
Heptanoate SCHEMBL21145196 0.87 GPR84 (0.53) CYP1A2CYP2C9CYP2C19AKR1B1GPR84
Dodecanoate SCHEMBL21145332 0.87 GPR84 (0.53) CYP1A2CYP2C9CYP2C19AKR1B1GPR84
Glycolic Acid SCHEMBL21145328 0.83 CYP1A2 (0.43) CYP1A2CYP2D6CYP2C9CYP2C19

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-20200179254-A1 IMPROVED CONDITIONING HAIR TREATMENT PRODUCT WITH WASHOUT PROTECTION HENKEL AG & CO. KGAA (DE) 2020-06-11 US disclosed
US-20190240129-A1 CONDITIONING HAIR TREATMENT PRODUCT WITH WASHOUT PROTECTION HENKEL AG & CO. KGAA (DE) 2019-08-08 US disclosed
US-20190216703-A1 IMPROVED CONDITIONING HAIR TREATMENT PRODUCT WITH WASHOUT PROTECTION HENKEL AG & CO. KGAA (DE) 2019-07-18 US disclosed
US-20190216714-A1 IMPROVED CONDITIONING HAIR TREATMENT PRODUCT WITH WASHOUT PROTECTION HENKEL AG & CO. KGAA (DE) 2019-07-18 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 (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-20190240129-A1 CONDITIONING HAIR TREATMENT PRODUCT WITH WASHOUT PROTECTION KRT18, CUTA, S100A10 FFAR3 2270/4885HDAC3 778/4885HDAC1 121/4885
US-20190216703-A1 IMPROVED CONDITIONING HAIR TREATMENT PRODUCT WITH WASHOUT PROTECTION KRT18, SRRM2, IK FFAR3 1837/4885HDAC3 644/4885HDAC1 193/4885
US-20190216714-A1 IMPROVED CONDITIONING HAIR TREATMENT PRODUCT WITH WASHOUT PROTECTION KRT18, CD44, PCNA FFAR3 3218/4885HDAC3 803/4885HDAC1 116/4885
US-20200179254-A1 IMPROVED CONDITIONING HAIR TREATMENT PRODUCT WITH WASHOUT PROTECTION KRT18, CUTA, DSG1 FFAR3 2914/4885HDAC3 406/4885HDAC1 62/4885

“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.