SCHEMBL23148484

SCHEMBL23148484

CCCCC(CC)C(=O)c1ccco1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
HDAC3 O15379 1/20 0.49
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
POLB P06746 3/20 0.46
AGTR1 P30556 1/20 0.46
CA2 P00918 3/20 0.44
MAPK1 P28482 2/20 0.44
GAA P10253 2/20 0.44
CA1 P00915 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL2303601 0.83 KMT2A (0.51) ALDH1A1HDAC3MEN1KMT2APOLB
SCHEMBL23754764 0.81 ALDH1A1 (0.56) ALDH1A1HDAC3MEN1KMT2APOLB
SCHEMBL27938441 0.81 ALDH1A1 (0.49) ALDH1A1HDAC3MEN1KMT2APOLB
2-Ethylhexanoic Acid SCHEMBL29018964 0.80 ALDH1A1 (0.55) ALDH1A1HDAC3MEN1KMT2ACA2
Propionic Acid SCHEMBL29018963 0.78 ALDH1A1 (0.53) ALDH1A1HDAC3MEN1KMT2ACA2
SCHEMBL7097301 0.77 KMT2A (0.46) ALDH1A1HDAC3MEN1KMT2APOLB
SCHEMBL18825667 0.77 GAA (0.48) ALDH1A1HDAC3MEN1KMT2APOLB
SCHEMBL18825668 0.77 GAA (0.48) ALDH1A1HDAC3MEN1KMT2APOLB
SCHEMBL27802933 0.76 POLB (0.47) ALDH1A1HDAC3MEN1KMT2APOLB
SCHEMBL28695937 0.76 ALDH1A1 (0.50) ALDH1A1HDAC3MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11718598-B2 Processes for the preparation of alkyl furans using bifunctional copper catalysts TRIAD NATIONAL SECURITY, LLC (US) 2023-08-08 US disclosed
US-11718598-B2 Processes for the preparation of alkyl furans using bifunctional copper catalysts TRIAD NATIONAL SECURITY, LLC (US) 2023-08-08 US disclosed
US-11718598-B2 Processes for the preparation of alkyl furans using bifunctional copper catalysts TRIAD NATIONAL SECURITY, LLC (US) 2023-08-08 US disclosed
US-20210094926-A1 PROCESSES FOR THE PREPARATION OF ALKYL FURANS USING BIFUNCTIONAL COPPER CATALYSTS U.S. DEPARTMENT OF ENERGY 2021-04-01 US disclosed
US-20210094926-A1 PROCESSES FOR THE PREPARATION OF ALKYL FURANS USING BIFUNCTIONAL COPPER CATALYSTS U.S. DEPARTMENT OF ENERGY 2021-04-01 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 (2 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-11718598-B2 Processes for the preparation of alkyl furans using bifunctional copper catalysts DUOX1, HAO2, ALOX15B ALDH1A1 260/4885HDAC3 4270/4885MEN1 3796/4885
US-20210094926-A1 PROCESSES FOR THE PREPARATION OF ALKYL FURANS USING BIFUNCTIONAL COPPER CATALYSTS DUOX1, HAO2, ALOX15B ALDH1A1 260/4885HDAC3 4270/4885MEN1 3796/4885

“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.