SCHEMBL24845694

SCHEMBL24845694

CC(=O)OC1(C)c2ccccc2-c2ccc(C)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 9/20 0.48
ELANE P08246 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
CASP3 P42574 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAOB P27338 1/20 0.36
LMNA P02545 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
THRB P10828 1/20 0.35
S100A4 P26447 1/20 0.34
MAPT P10636 1/20 0.34
ITGA4 P13612 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
SCHEMBL24845691 0.83 PDK2 (0.49) PDK2ELANETDP1MAOBLMNA
SCHEMBL3633870 0.73 THRB (0.48) PDK2TDP1ALDH1A1ESR1ESR2
SCHEMBL26781883 0.73 ALDH1A1 (0.38) L3MBTL1TDP1RAB9AALDH1A1LMNA
SCHEMBL19718972 0.72 PDK2 (0.41) PDK2
SCHEMBL18832681 0.72 PDK2 (0.62) PDK2ELANEL3MBTL1TDP1CASP3
SCHEMBL2774493 0.71 ELANE (0.41) PDK2ELANETDP1ALDH1A1LMNA
SCHEMBL24355593 0.71 THRB (0.45) PDK2L3MBTL1TDP1ALDH1A1LMNA
SCHEMBL18463551 0.71 PDK2 (0.56) PDK2ELANEL3MBTL1TDP1CASP3
SCHEMBL19771500 0.71 PDK2 (0.43) PDK2
SCHEMBL6154693 0.70 MAPT (0.46) PDK2TDP1RAB9ANPSR1ALDH1A1

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-20230002416-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES UDC IRELAND LIMITED (IE) 2023-01-05 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-20230002416-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES GPX1, L1CAM, TMEM109 PDK2 1581/4885ELANE 201/4885L3MBTL1 2636/4885

“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.