SCHEMBL22473769

SCHEMBL22473769

CC(C)NC(=O)CCCCCn1cc(CCCC(=O)S)nn1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.46
FOLH1 Q04609 2/20 0.44
HDAC1 Q13547 14/20 0.43
GBA1 P04062 3/20 0.42
HDAC3 O15379 3/20 0.42
HDAC4 P56524 3/20 0.42
HDAC7 Q8WUI4 3/20 0.42
HDAC2 Q92769 3/20 0.42
HDAC10 Q969S8 3/20 0.42
HDAC11 Q96DB2 3/20 0.42
HDAC8 Q9BY41 3/20 0.42
HDAC6 Q9UBN7 3/20 0.42
HDAC9 Q9UKV0 3/20 0.42
HDAC5 Q9UQL6 3/20 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
SCHEMBL22473750 0.86 FOLH1 (0.48) EPHX2FOLH1HDAC1
SCHEMBL18161456 0.86 FOLH1 (0.58) EPHX2FOLH1HDAC1
SCHEMBL22473814 0.85 EPHX2 (0.47) EPHX2FOLH1HDAC1GBA1
SCHEMBL22473681 0.85 EPHX2 (0.47) EPHX2FOLH1HDAC1GBA1
SCHEMBL22473755 0.85 EPHX2 (0.43) EPHX2FOLH1HDAC1HDAC3HDAC4
SCHEMBL22473767 0.85 GBA1 (0.46) EPHX2FOLH1HDAC1GBA1HDAC3
SCHEMBL22473749 0.84 HDAC1 (0.47) EPHX2FOLH1HDAC1HDAC3HDAC4
SCHEMBL22473676 0.84 EPHX2 (0.46) EPHX2FOLH1HDAC1HDAC3HDAC4
SCHEMBL22473665 0.84 EPHX2 (0.46) EPHX2FOLH1HDAC1HDAC3HDAC4
SCHEMBL22473679 0.84 EPHX2 (0.46) EPHX2FOLH1HDAC1HDAC3HDAC4

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 EPHX2 557/4885FOLH1 350/4885HDAC1 1577/4885

“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.