SCHEMBL27015159

SCHEMBL27015159

CC(C)(C)CCCCCC(=O)NCc1cn(CCOCCC(C)(C)C)nn1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 10/20 0.40
HDAC3 O15379 7/20 0.40
HDAC4 P56524 7/20 0.40
HDAC7 Q8WUI4 7/20 0.40
HDAC2 Q92769 7/20 0.40
HDAC10 Q969S8 7/20 0.40
HDAC11 Q96DB2 7/20 0.40
HDAC8 Q9BY41 7/20 0.40
HDAC6 Q9UBN7 7/20 0.40
HDAC9 Q9UKV0 7/20 0.40
HDAC5 Q9UQL6 7/20 0.40
NCOR2 Q9Y618 1/20 0.40
GBA1 P04062 1/20 0.40
GLS O94925 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
SCHEMBL27015297 0.95 GBA1 (0.44) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL26721202 0.94 GBA1 (0.48) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL27015161 0.89 HDAC1 (0.44) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL24922950 0.84 HDAC1 (0.41) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL19592512 0.78 GLS (0.38) GBA1GLS
SCHEMBL13596303 0.77 GLS (0.37) GBA1GLS
SCHEMBL22643804 0.77 GLS (0.43) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL19535085 0.77 GBA1 (0.53) GBA1
SCHEMBL22334356 0.77 DRD2 (0.47)
SCHEMBL13596564 0.76 GLS (0.38) GBA1GLS

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-20240016949-A1 ANTIBODY-DRUG CONJUGATE, AND INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF SHANGHAI FUDAN-ZHANGJIANG BIO-PHARMACEUTICAL CO., LTD. (CN) 2024-01-18 US disclosed
US-20240016949-A1 ANTIBODY-DRUG CONJUGATE, AND INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF SHANGHAI FUDAN-ZHANGJIANG BIO-PHARMACEUTICAL CO., LTD. (CN) 2024-01-18 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-20240016949-A1 ANTIBODY-DRUG CONJUGATE, AND INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF VSIG8, CD81, WEE1 HDAC1 1163/4885HDAC3 904/4885HDAC4 1032/4885

“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.