Butyric Acid

Butyric Acid

SCHEMBL4155439

CCCC(=O)O.C[C@@H](CN(C1CC1)S(=O)(=O)c1ccc2[nH]c(=O)c3[nH]ccc3c2c1)NC(=O)OC(C)(C)C

nearest known ligand 0.33

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
BRD4 O60885 1/20 0.32
TP53 P04637 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
CA2 P00918 2/20 0.32
CA1 P00915 1/20 0.32
CA4 P22748 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
SCN9A Q15858 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 1/20 0.30

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
Butyric Acid SCHEMBL4153572 1.00 KDM4E (0.33) KDM4EBRD4TP53RXFP1CA2
SCHEMBL4715853 0.95 CA2 (0.35) KDM4EBRD4TP53RXFP1CA2
SCHEMBL4714851 0.95 CA2 (0.35) KDM4EBRD4TP53RXFP1CA2
Butyric Acid SCHEMBL4166445 0.85 KDM4E (0.33) KDM4EBRD4TP53RXFP1KEAP1
Butyric Acid SCHEMBL4166269 0.84 KDM4E (0.37) KDM4ETP53RXFP1KEAP1NFE2L2
Butyric Acid SCHEMBL4155430 0.84 KDM4E (0.37) KDM4ETP53RXFP1KEAP1NFE2L2
SCHEMBL4153570 0.83 SCN9A (0.32) KDM4ETP53CA2SCN9ALMNA
SCHEMBL3250002 0.83 MAPT (0.35) KDM4ETP53CA2CA1CA4
SCHEMBL3246215 0.83 MAPT (0.35) KDM4ETP53CA2CA1CA4
SCHEMBL3246221 0.83 MAPT (0.35) KDM4ETP53CA2CA1CA4

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-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US claimed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 US claimed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 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 (1 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-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors MAP3K1, MAP3K2, MAP3K7 KDM4E 1970/4885BRD4 545/4885TP53 637/4885

“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.