SCHEMBL26329075

SCHEMBL26329075

O=C1[C@@H](Oc2ccc(OCc3ccccc3)nc2OCc2ccccc2)CCN1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
ROCK2 O75116 1/20 0.41
MCHR1 Q99705 9/20 0.41
DDB1 Q16531 2/20 0.40
CRBN Q96SW2 2/20 0.40
GRM5 P41594 1/20 0.39
GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL21903078 1.00 HDAC8 (0.43) HDAC8HDAC6ROCK2MCHR1DDB1
SCHEMBL26329071 0.83 MCHR1 (0.44) HDAC8HDAC6ROCK2MCHR1
SCHEMBL20595486 0.79 HTR2C (0.42)
SCHEMBL31108082 0.79 HTR2C (0.42)
SCHEMBL23702952 0.71 HDAC8 (0.49) HDAC8HDAC6ROCK2MCHR1DDB1
SCHEMBL26772947 0.71 HDAC8 (0.49) HDAC8HDAC6ROCK2MCHR1DDB1
SCHEMBL20595416 0.70 NPC1 (0.42)
SCHEMBL21965434 0.70 SLC6A4 (0.41) GRM5
SCHEMBL22119554 0.67 RAB9A (0.52) HDAC6
SCHEMBL9407245 0.66 HDAC8 (0.52) HDAC8HDAC6ROCK2MCHR1DDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230279023-A1 N/O-Linked Degrons and Degronimers for Protein Degradation C4 THERAPEUTICS, INC. (US) 2023-09-07 US disclosed
US-20230279023-A1 N/O-Linked Degrons and Degronimers for Protein Degradation C4 THERAPEUTICS, INC. (US) 2023-09-07 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-20230279023-A1 N/O-Linked Degrons and Degronimers for Protein Degradation CRBN, CBL, STUB1 HDAC8 3091/4885HDAC6 2941/4885ROCK2 3455/4885

“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.