SCHEMBL26569653

SCHEMBL26569653

Cc1nc(C)c(C(C)(C)C)cc1-c1ccc([Si](C)(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 3/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
TRPA1 O75762 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL26569654 0.82 KIF11 (0.42) KDM4EALDH1A1MAPTNPSR1
SCHEMBL26569655 0.80 PSMB5 (0.50) PSMB5KDM4EALDH1A1MAPTTRPA1
SCHEMBL3481745 0.70 NR1H2 (0.38) NR1H2NR1H3
SCHEMBL5546191 0.67 ACHE (0.35) KDM4EALDH1A1MAPTNR1H2NR1H3
SCHEMBL25763024 0.66 ACHE (0.34) KDM4EALDH1A1MAPTNR1H2NR1H3
SCHEMBL26569683 0.66 SMN1; SMN2 (0.38) PSMB5ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL26569652 0.66 HSP90AA1 (0.33)
SCHEMBL19735232 0.65 KIF11 (0.58) KDM4EALDH1A1MAPTNR1H2NR1H3
SCHEMBL10997473 0.65 NR1H2 (0.44) ALDH1A1MAPTNR1H2NR1H3
SCHEMBL28308652 0.65 NR1H2 (0.44) ALDH1A1MAPTNR1H2NR1H3

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-20230337517-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-19 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-20230337517-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LBR, OCIAD2, OCIAD1 PSMB5 3497/4885KDM4E 3832/4885ALDH1A1 1442/4885

“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.