SCHEMBL29326683

SCHEMBL29326683

OBOc1cccc2c1-c1ccccc1C21c2ccccc2-c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 11/20 0.41
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
THRB P10828 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL26808478 0.90 PDK2 (0.37) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL29326538 0.89 PDK2 (0.39) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26808387 0.83 KDM4E (0.35) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL19196614 0.82 PDK2 (0.43) PDK2
SCHEMBL18156809 0.82 PDK2 (0.32) PDK2
SCHEMBL26808384 0.81 KDM4E (0.34) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL30749099 0.77 PDK2 (0.59) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26808457 0.76 PDK2 (0.41) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26808495 0.76 PDK2 (0.34) PDK2ESR1ESR2
SCHEMBL7805289 0.75 TDP1 (0.41) PDK2KDM4EMEN1LMNAMAPT

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-12043627-B2 Compound and color conversion film comprising same LG CHEM, LTD. (KR) 2024-07-23 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-12043627-B2 Compound and color conversion film comprising same CRY1, FLI1, FDFT1 PDK2 1958/4885KDM4E 662/4885MEN1 206/4885

“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.