SCHEMBL26549672

SCHEMBL26549672

CC(C)(C)c1ccccc1C(C)(C)CCC(C)(C)c1cnccc1C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
TDP1 Q9NUW8 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
KIF11 P52732 1/20 0.33
CA2 P00918 1/20 0.32
HTT P42858 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
SLC22A12 Q96S37 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL22428716 0.96 ALOX5 (0.36) ALOX5PTGS1PTGS2TDP1ALDH1A1
SCHEMBL24995534 0.82 ALOX5 (0.35) ALOX5PTGS1PTGS2KIF11
SCHEMBL26549674 0.81 ALOX5 (0.35) ALOX5PTGS1PTGS2KIF11
SCHEMBL1705592 0.78 KIF11 (0.39) ALOX5PTGS1PTGS2TDP1ALDH1A1
SCHEMBL13412862 0.76 ALOX5 (0.36) ALOX5PTGS1PTGS2KIF11CA2
SCHEMBL21150744 0.74 TDP1 (0.35) TDP1ALDH1A1TSHRCA2HTT
SCHEMBL18235336 0.72 KIF11 (0.35) ALOX5PTGS1PTGS2ALDH1A1KIF11
SCHEMBL12341054 0.71 LATS1 (0.40) ALOX5PTGS1PTGS2ALDH1A1KIF11
SCHEMBL12680655 0.71 ALDH1A1 (0.46) TDP1ALDH1A1TSHRKIF11CA2
SCHEMBL24622864 0.70 TAAR1 (0.35) KIF11

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-20230322724-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS AURIGENE ONCOLOGY LIMITED (IN) 2023-10-12 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-20230322724-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS EP300, HDAC1, BRD3 ALOX5 3148/4885PTGS1 822/4885PTGS2 1192/4885

“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.