SCHEMBL23815596

SCHEMBL23815596

CC(=O)c1ccc2nc(-c3nc(NC(C)C)cn3C)[nH]c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.43
HDAC6 Q9UBN7 6/20 0.43
HDAC3 O15379 4/20 0.43
HDAC1 Q13547 3/20 0.43
HDAC8 Q9BY41 3/20 0.43
HDAC2 Q92769 2/20 0.43
RAB9A P51151 1/20 0.43
CHEK2 O96017 4/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
NPBWR1 P48145 1/20 0.41
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
DGAT1 O75907 1/20 0.40
HSP90AA1 P07900 1/20 0.39
ESR2 Q92731 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP3A4 P08684 1/20 0.38
THRB P10828 1/20 0.38
PKN1 Q16512 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
SCHEMBL25694613 0.90 HDAC6 (0.42) BRD4HDAC6HDAC3HDAC1HDAC8
SCHEMBL23815574 0.89 HDAC6 (0.41) BRD4HDAC6HDAC3HDAC1HDAC8
SCHEMBL12582122 0.88 BRD4 (0.45) BRD4HDAC6HDAC3HDAC1HDAC8
SCHEMBL23744822 0.85 BRD4 (0.43) BRD4HDAC6HDAC3HDAC1HDAC8
SCHEMBL23815542 0.85 BRD4 (0.43) BRD4HDAC6HDAC3HDAC1HDAC8
SCHEMBL23745079 0.83 CHEK2 (0.47) BRD4HDAC6HDAC3RAB9ACHEK2
SCHEMBL23815554 0.81 BRD4 (0.44) BRD4HDAC6HDAC3HDAC1HDAC8
SCHEMBL26242966 0.81 CHEK2 (0.48) BRD4HDAC6HDAC3RAB9ACHEK2
SCHEMBL23815683 0.78 HDAC6 (0.41) BRD4HDAC6HDAC3HDAC1HDAC8
SCHEMBL25698369 0.78 HDAC6 (0.41) BRD4HDAC6HDAC3HDAC1HDAC8

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-20210284629-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-09-16 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-20210284629-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, UBQLN2, UBTF BRD4 392/4885HDAC6 357/4885HDAC3 1673/4885

“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.