SCHEMBL27094643

SCHEMBL27094643

CC(C)OC(=O)c1ccc(C(=O)OCCC(C)(C)O)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
AKR1B1 P15121 1/20 0.37
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
CA14 Q9ULX7 2/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL24691973 0.92 CYP4F2 (0.40) HDAC4HDAC6CYP4F2CYP4A11ALDH1A1
SCHEMBL27094852 0.90 HDAC4 (0.42) HDAC4HDAC6CYP4F2CYP4A11ALDH1A1
SCHEMBL28655253 0.82 MAOB (0.49) HDAC4HDAC6CYP4F2CYP4A11ALDH1A1
SCHEMBL21402037 0.82 CYP4F2 (0.47) HDAC4HDAC6CYP4F2CYP4A11ALDH1A1
SCHEMBL17879788 0.81 RAB9A (0.46) HDAC4HDAC6ALDH1A1HPGDRAB9A
SCHEMBL18102081 0.81 KMT2A (0.45) HDAC4HDAC6CYP4F2CYP4A11ALDH1A1
SCHEMBL22894613 0.80 CYP4F2 (0.49) HDAC4HDAC6CYP4F2CYP4A11ALDH1A1
SCHEMBL26981005 0.79 CYP4F2 (0.52) CYP4F2CYP4A11ALDH1A1CYP2C9CYP2C19
SCHEMBL28668738 0.79 HDAC4 (0.59) HDAC4HDAC6CYP4F2CYP4A11ALDH1A1
SCHEMBL28654141 0.77 TSHR (0.50) HDAC4HDAC6CYP4F2CYP4A11ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11905362-B2 Polymers and methods of producing thereof ORIGIN MATERIALS OPERATING, INC. (US) 2024-02-20 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-11905362-B2 Polymers and methods of producing thereof HPD, PARN, PARG HDAC4 2504/4885HDAC6 1909/4885CYP4F2 90/4885

“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.