SCHEMBL26050366

SCHEMBL26050366

CC1(C)c2cc(-c3ccc(Cl)cc3)ccc2-c2ccc(-c3ccc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)cc21

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 13/20 0.50
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
OPRK1 P41145 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
PGR P06401 3/20 0.37
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35

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
SCHEMBL12362770 0.93 PDK2 (0.56) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL31464140 0.93 PDK2 (0.56) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26050380 0.93 PDK2 (0.56) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26050409 0.93 PDK2 (0.56) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26058319 0.91 PDK2 (0.48) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26050362 0.88 PDK2 (0.41) PDK2LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL24257893 0.88 PDK2 (0.40) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL22151245 0.87 PDK2 (0.51) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL30865781 0.87 PDK2 (0.59) PDK2CYP1A2PGR
SCHEMBL24665388 0.87 PDK2 (0.59) PDK2CYP1A2PGR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230271989-A1 METAL COMPLEXES UDC IRELAND LIMITED (IE) 2023-08-31 US disclosed
US-20230271989-A1 METAL COMPLEXES UDC IRELAND LIMITED (IE) 2023-08-31 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-20230271989-A1 METAL COMPLEXES AP3M1, AP1M1, AP2M1 PDK2 1385/4885KDM4E 3576/4885MEN1 1025/4885

“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.