SCHEMBL21064633

SCHEMBL21064633

CC(C)Cc1ccc(S(=O)(=O)c2cccc(CC(C)C)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
HTR6 P50406 2/20 0.49
KDM4E B2RXH2 3/20 0.43
CA2 P00918 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.40
EPHX1 P07099 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL27876500 0.93 HTR6 (0.50) ALDH1A1HTR6KDM4ECA2SMN1; SMN2
SCHEMBL10180389 0.92 HTR6 (0.58) ALDH1A1HTR6CA2SMN1; SMN2POLB
SCHEMBL10181468 0.86 HTR6 (0.55) ALDH1A1HTR6KDM4ESMN1; SMN2KMT2A
SCHEMBL21064584 0.86 ALDH1A1 (0.61) ALDH1A1KDM4ESMN1; SMN2POLBKMT2A
SCHEMBL103049 0.82 GAA (0.61) ALDH1A1KDM4ESMN1; SMN2POLBKMT2A
SCHEMBL10181528 0.81 NR1H2 (0.45) ALDH1A1
SCHEMBL13703527 0.80 CA2 (0.39) ALDH1A1HTR6CA2SMN1; SMN2TSHR
SCHEMBL23665873 0.79 NPC1 (0.42) ALDH1A1HTR6KDM4ECA2
SCHEMBL10180429 0.79 PSIP1 (0.48) ALDH1A1HTR6KDM4ECA2
SCHEMBL13241241 0.79 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNATSHR

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-10312455-B2 Delayed fluorescence material for organic electroluminescence device LUMINESCENCE TECHNOLOGY CORP. (TW) 2019-06-04 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-10312455-B2 Delayed fluorescence material for organic electroluminescence device SOD1, GPX1, LEF1 ALDH1A1 352/4885HTR6 2605/4885KDM4E 3381/4885

“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.