SCHEMBL26109627

SCHEMBL26109627

CSc1ncc(-c2cn(CCCCCC(=O)NCC(=O)NCC(=O)NC(Cc3ccccc3)C(=O)O)nn2)cn1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 18/20 0.49
▸ HDAC1 Q13547 18/20 0.49
▸ HDAC2 Q92769 18/20 0.49
▸ HDAC4 P56524 16/20 0.49
▸ HDAC7 Q8WUI4 16/20 0.49
▸ HDAC10 Q969S8 16/20 0.49
▸ HDAC11 Q96DB2 16/20 0.49
▸ HDAC8 Q9BY41 16/20 0.49
▸ HDAC6 Q9UBN7 16/20 0.49
▸ HDAC9 Q9UKV0 16/20 0.49
▸ HDAC5 Q9UQL6 16/20 0.49
▸ NAMPT P43490 3/20 0.44
▸ NCOR2 Q9Y618 2/20 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
SCHEMBL27183478 1.00 HDAC3 (0.49) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL26108499 0.85 FOLH1 (0.41) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL26527860 0.85 FOLH1 (0.41) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL26108502 0.85 FOLH1 (0.41) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL24642649 0.80 EGLN1 (0.38) —
SCHEMBL26109623 0.79 HDAC3 (0.42) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL26108152 0.79 EPHX2 (0.47) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL26527855 0.76 EGLN1 (0.35) —
SCHEMBL28872459 0.75 HDAC3 (0.50) HDAC3HDAC1HDAC2HDAC4HDAC7
SCHEMBL24642914 0.75 ITGB1 (0.42) HDAC3HDAC1HDAC2HDAC4HDAC7

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-20240108745-A1 BIOACTIVE SUBSTANCE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF MEDILINK THERAPEUTICS (SUZHOU) CO., LTD. (CN) 2024-04-04 — — US disclosed
EP-4257154-A1 BIOACTIVE SUBSTANCE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF Medilink Therapeutics (Suzhou) Co., Ltd. (CN) 2023-10-11 — — EP 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-20240108745-A1 BIOACTIVE SUBSTANCE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF CTSL, VIP, FURIN HDAC3 4136/4885HDAC1 2969/4885HDAC2 4011/4885

“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.

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