SCHEMBL26054578

SCHEMBL26054578

CC(C)(C)C(=O)c1cc2cccc3c2n(c1=O)CC3

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.58
MCL1 Q07820 1/20 0.45
KDM4E B2RXH2 10/20 0.40
ALDH1A1 P00352 4/20 0.40
RAB9A P51151 3/20 0.40
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
USP2 O75604 1/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
ALOX5 P09917 1/20 0.35
HTT P42858 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL26054579 0.92 MCL1 (0.55) AHRMCL1KDM4EALDH1A1POLB
SCHEMBL12168242 0.83 AHR (0.62) AHRMCL1KDM4EALDH1A1RAB9A
SCHEMBL30237959 0.83 AHR (0.62) AHRMCL1KDM4EALDH1A1RAB9A
SCHEMBL3137864 0.79 KDM4E (0.60) AHRMCL1KDM4EALDH1A1RAB9A
SCHEMBL2741823 0.79 AHR (0.55) AHRMCL1KDM4EALDH1A1RAB9A
SCHEMBL25207046 0.76 AHR (0.80) AHRKDM4EALDH1A1RAB9APOLB
SCHEMBL30395855 0.76 AHR (0.80) AHRKDM4EALDH1A1RAB9APOLB
SCHEMBL17520233 0.76 AHR (0.50) AHRMCL1KDM4EALDH1A1RAB9A
SCHEMBL25209337 0.76 AHR (0.78) AHRALDH1A1RAB9ASMN1; SMN2LMNA
SCHEMBL30395655 0.76 AHR (0.78) AHRALDH1A1RAB9ASMN1; SMN2LMNA

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-11731967-B2 Inhibitors of TRIM33 and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-22 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-11731967-B2 Inhibitors of TRIM33 and methods of use TRIM33, TRIM28, TRIM4 AHR 4055/4885MCL1 857/4885KDM4E 1284/4885

“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.