SCHEMBL30142692

SCHEMBL30142692

Cc1nc(NC(=O)c2ccccc2NC(=O)CCCCCNC(=O)OC(C)(C)C)sc1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.41
▸ HDAC3 O15379 14/20 0.41
▸ HDAC1 Q13547 12/20 0.40
▸ HPGD P15428 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ NCOR2 Q9Y618 1/20 0.39
▸ GBA1 P04062 1/20 0.39

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
SCHEMBL30142696 0.89 MEN1 (0.40) HDAC3HDAC1HPGDSMN1; SMN2
SCHEMBL29057138 0.89 MEN1 (0.40) HDAC3HDAC1HPGDSMN1; SMN2
SCHEMBL25143602 0.88 NPC1 (0.47) CYP3A4HDAC3HDAC1SMN1; SMN2HDAC2
SCHEMBL24072476 0.85 MAPT (0.43) CYP3A4HDAC3HDAC1HDAC2HDAC10
SCHEMBL25063052 0.84 HDAC3 (0.45) CYP3A4HDAC3HDAC1HPGDSMN1; SMN2
SCHEMBL25063110 0.84 HDAC3 (0.45) CYP3A4HDAC3HDAC1HPGDSMN1; SMN2
SCHEMBL25063094 0.84 HDAC3 (0.45) CYP3A4HDAC3HDAC1HPGDSMN1; SMN2
SCHEMBL25063360 0.84 HDAC3 (0.45) CYP3A4HDAC3HDAC1HPGDSMN1; SMN2
SCHEMBL25063179 0.84 HDAC3 (0.45) CYP3A4HDAC3HDAC1HPGDSMN1; SMN2
SCHEMBL25063128 0.84 HDAC3 (0.45) CYP3A4HDAC3HDAC1HPGDSMN1; SMN2

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-20240066136-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-29 — — US disclosed
US-20230057177-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI), INC. (CN) 2023-02-23 — — 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 (2 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-20240066136-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS DDB1, DCLRE1A, MDM2 CYP3A4 2625/4885HDAC3 1547/4885HDAC1 924/4885
US-20230057177-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS DDB1, DCLRE1A, MDM2 CYP3A4 2625/4885HDAC3 1547/4885HDAC1 924/4885

“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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