SCHEMBL6294152

SCHEMBL6294152

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccc(-c4ccc5c(c4)C4(c6cc(-c7ccc(-c8ccc9c(c8)C8(c%10ccccc%10-c%10ccccc%108)c8ccccc8-9)cc7)ccc6-5)c5cc(-c6ccc(-c7ccc8c(c7)C7(c9ccccc9-c9ccccc97)c7ccccc7-8)cc6)ccc5-c5ccc(-c6ccc(-c7ccc8c(c7)C7(c9ccccc9-c9ccccc97)c7ccccc7-8)cc6)cc54)cc3)cc21

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 19/20 0.53
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
OPRK1 P41145 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL6297506 0.98 PDK2 (0.50) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL29512055 0.98 PDK2 (0.50) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL29756478 0.98 PDK2 (0.50) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL416947 0.98 PDK2 (0.50) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL29424156 0.98 PDK2 (0.50) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL415665 0.98 PDK2 (0.50) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL5859559 0.96 PDK2 (0.59) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL4321761 0.96 PDK2 (0.59) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25685038 0.96 PDK2 (0.59) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL5859662 0.96 PDK2 (0.59) PDK2MEN1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6861567-B2 Spiro compounds, and their use COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2005-03-01 US disclosed
EP-1053216-B1 SPIRANS AND THE USE THEREOF COVION ORGANIC SEMICONDUCTORS (DE) 2003-09-10 EP disclosed
US-20030065190-A1 Spiro compounds, and their use MERCK OLED MATERIALS GMBH (DE) 2003-04-03 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-20030065190-A1 Spiro compounds, and their use PKD1, REN, NR3C2 PDK2 756/4885KDM4E 4514/4885MEN1 398/4885

“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.