SCHEMBL30613468

SCHEMBL30613468

CC(C)(C)OC(=O)NCCC[C@H](NC(=O)c1cccc(Br)c1)c1ncc(-c2ccccc2)o1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.45
▸ SUCNR1 Q9BXA5 8/20 0.41
▸ ACACB O00763 1/20 0.41
▸ ACACA Q13085 1/20 0.41
▸ TP53BP1 Q12888 1/20 0.40
▸ CTSB P07858 1/20 0.40
▸ CTSS P25774 1/20 0.40
▸ CTSK P43235 1/20 0.40
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ PAX8 Q06710 1/20 0.39
▸ GABRA5 P31644 1/20 0.38
▸ NPSR1 Q6W5P4 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 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
SCHEMBL24302609 1.00 MAPT (0.45) MAPTSUCNR1ACACBACACATP53BP1
SCHEMBL24301589 1.00 MAPT (0.45) MAPTSUCNR1ACACBACACATP53BP1
SCHEMBL29025671 0.93 MAPT (0.40) MAPTSUCNR1TP53BP1HDAC1HDAC6
SCHEMBL30613466 0.93 MAPT (0.40) MAPTSUCNR1TP53BP1HDAC1HDAC6
SCHEMBL24301627 0.93 MAPT (0.40) MAPTSUCNR1TP53BP1HDAC1HDAC6
SCHEMBL24301576 0.89 MAPT (0.46) MAPTSUCNR1ACACBACACAHDAC1
SCHEMBL30613457 0.89 MAPT (0.46) MAPTSUCNR1ACACBACACAHDAC1
SCHEMBL30504329 0.89 MAPT (0.46) MAPTSUCNR1ACACBACACAHDAC1
SCHEMBL26667415 0.88 HDAC1 (0.44) MAPTTP53BP1CTSBCTSSCTSK
SCHEMBL26667413 0.88 HDAC1 (0.44) MAPTTP53BP1CTSBCTSSCTSK

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-20230381146-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND USE THEREOF HELIOS HUAMING BIOPHARMA CO., LTD. (CN) 2023-11-30 — — 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-20230381146-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND USE THEREOF SSB, BTK, PADI6 MAPT 790/4885SUCNR1 1963/4885ACACB 780/4885

“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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