SCHEMBL25815148

SCHEMBL25815148

Cc1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 9/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
OPRK1 P41145 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KIF11 P52732 1/20 0.34
HPRT1 P00492 1/20 0.33
POLB P06746 1/20 0.32
AGTR1 P30556 1/20 0.31
FLT3 P36888 1/20 0.30
PTPRC P08575 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
SCHEMBL16852527 1.00 PDK2 (0.41) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL16852534 0.99 PDK2 (0.40) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL17465482 0.99 PDK2 (0.42) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL17805085 0.99 PDK2 (0.42) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL19444946 0.97 PDK2 (0.41) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL16996139 0.97 PDK2 (0.43) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL17854536 0.96 MEN1 (0.39) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL16922950 0.96 PDK2 (0.40) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL18912545 0.96 PDK2 (0.42) PDK2ESR1ESR2MEN1KMT2A
SCHEMBL16996428 0.96 PDK2 (0.42) PDK2ESR1ESR2MEN1KMT2A

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-20230225196-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-13 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-20230225196-A1 MATERIALS FOR ELECTRONIC DEVICES SELE, EPHA6, EPX PDK2 1021/4885ESR1 31/4885ESR2 162/4885

“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.