SCHEMBL22473784

SCHEMBL22473784

CNC(=O)CCCCCn1cc(COCCOCCOCCOCCOCCOC)nn1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 8/20 0.59
HDAC3 O15379 11/20 0.45
HDAC4 P56524 11/20 0.45
HDAC1 Q13547 11/20 0.45
HDAC7 Q8WUI4 11/20 0.45
HDAC2 Q92769 11/20 0.45
HDAC10 Q969S8 11/20 0.45
HDAC11 Q96DB2 11/20 0.45
HDAC8 Q9BY41 11/20 0.45
HDAC6 Q9UBN7 11/20 0.45
HDAC9 Q9UKV0 11/20 0.45
HDAC5 Q9UQL6 11/20 0.45
GBA1 P04062 1/20 0.42

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
SCHEMBL22473684 0.88 DGAT1 (0.61) DGAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL22473624 0.87 DGAT1 (0.49) DGAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL22473629 0.87 DGAT1 (0.59) DGAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL22473810 0.87 DGAT1 (0.60) DGAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL22473820 0.85 DGAT1 (0.47) DGAT1HDAC3HDAC1HDAC2GBA1
SCHEMBL22473625 0.84 DGAT1 (0.59) DGAT1GBA1
SCHEMBL22473778 0.83 DGAT1 (0.60) DGAT1
SCHEMBL22473764 0.82 DGAT1 (0.57) DGAT1GBA1
SCHEMBL31502356 0.80 DGAT1 (0.53) DGAT1GBA1
SCHEMBL22473779 0.80 DGAT1 (0.52) DGAT1HDAC3HDAC4HDAC1HDAC7

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-10787443-B2 RAF-degrading conjugate compounds ZAMBONI CHEM SOLUTIONS INC. (CA) 2020-09-29 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-10787443-B2 RAF-degrading conjugate compounds BRAF, RAF1, ARAF DGAT1 1679/4885HDAC3 2276/4885HDAC4 1880/4885

“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.