SCHEMBL17070769

SCHEMBL17070769

Cc1c(C)c(C)c(-c2cc3c(c4ccccc24)-c2ccc(Br)cc2C3(C)C)c(C)c1C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.33
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
ALK Q9UM73 4/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
PGR P06401 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
SCHEMBL17264183 0.85 PDK2 (0.35) PDK2CA1CA2CA4CA6
SCHEMBL15505860 0.84 PDK2 (0.35) PDK2CA1CA2CA4CA6
SCHEMBL15505778 0.84 PRNP (0.34) PDK2CA1CA2CA4CA6
SCHEMBL14063305 0.84 PDK2 (0.36) PDK2CA1CA2CA4CA6
SCHEMBL29963982 0.84 PDK2 (0.36) PDK2CA1CA2CA4CA6
SCHEMBL17070771 0.82 MGAM (0.32) PDK2MGAMGAASIMGAM2
SCHEMBL15505764 0.81 MAPT (0.35) PDK2
SCHEMBL160603 0.81 PDK2 (0.37) PDK2CA1CA2CA4CA6
SCHEMBL15505859 0.81 PDK2 (0.35) PDK2CA1CA2GAA
SCHEMBL17070775 0.80 KCNK2 (0.32) PDK2CA1CA2CA4CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10439145-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2019-10-08 US disclosed
EP-2941472-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-07-25 EP disclosed
US-20150329772-A1 Materials for Electronic Devices MERCK PATENT GMBH (DE) 2015-11-19 US disclosed
US-20150329772-A1 Materials for Electronic Devices MERCK PATENT GMBH (DE) 2015-11-19 US disclosed
US-20150255720-A1 Compounds for Electronic Devices MERCK PATENT GMBH (DE) 2015-09-10 US disclosed
US-20150255720-A1 Compounds for Electronic Devices MERCK PATENT GMBH (DE) 2015-09-10 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 (3 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-10439145-B2 Compounds for electronic devices DDT, EED, VDAC2 PDK2 671/4885CA1 2817/4885CA2 2969/4885
US-20150255720-A1 Compounds for Electronic Devices DDT, EED, VDAC2 PDK2 671/4885CA1 2817/4885CA2 2969/4885
US-20150329772-A1 Materials for Electronic Devices EFNA1, SDHB, ETFA PDK2 1170/4885CA1 2831/4885CA2 4387/4885

“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.