SCHEMBL25936345

SCHEMBL25936345

CC(C)N1CC2CN(c3ncc(C(C)(C)C)cn3)CC2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 5/20 0.43
▸ OGA O60502 6/20 0.33
▸ HDAC3 O15379 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC7 Q8WUI4 1/20 0.32
▸ HDAC2 Q92769 1/20 0.32
▸ HDAC10 Q969S8 1/20 0.32
▸ HDAC11 Q96DB2 1/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.32
▸ HDAC9 Q9UKV0 1/20 0.32
▸ HDAC5 Q9UQL6 1/20 0.32
▸ HRH3 Q9Y5N1 3/20 0.31
▸ HCRTR1 O43613 1/20 0.31
▸ HCRTR2 O43614 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ CAMK1D Q8IU85 1/20 0.31

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
SCHEMBL24827892 0.81 ACACB (0.35) ACACBOGAHDAC3HDAC4HDAC1
SCHEMBL24827848 0.81 ACACB (0.39) ACACBHDAC3HDAC4HDAC1HDAC7
SCHEMBL21419379 0.79 OGA (0.46) ACACBOGAHRH3MEN1KMT2A
SCHEMBL26153030 0.78 ACACB (0.41) ACACBHDAC3HDAC4HDAC1HDAC7
SCHEMBL21419371 0.75 ACACB (0.41) ACACBHDAC3HDAC4HDAC1HDAC7
SCHEMBL12459040 0.75 ACACB (0.44) ACACBOGAMEN1KMT2ATDP1
SCHEMBL19001108 0.73 ACACB (0.41) ACACBHRH3MEN1KMT2ACAMK1D
SCHEMBL19001252 0.73 ACACB (0.41) ACACBHRH3MEN1KMT2ACAMK1D
SCHEMBL19012606 0.72 HDAC6 (0.41) ACACBHDAC6MEN1KMT2ATDP1
SCHEMBL26153017 0.72 ACACB (0.40) ACACBMEN1KMT2ATDP1CAMK1D

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-20230248833-A1 COMPOUND HAVING BTK KINASE DEGRADING ACTIVITY, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREFOR XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) 2023-08-10 — — 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-20230248833-A1 COMPOUND HAVING BTK KINASE DEGRADING ACTIVITY, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREFOR BTK, WEE1, WEE2 ACACB 3289/4885OGA 2246/4885HDAC3 3006/4885

“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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