SCHEMBL20345944

SCHEMBL20345944

CC1(C)c2ccccc2-c2ccc(N(c3cccc(C4(C)c5ccccc5-c5ccccc54)c3)c3cccc4c3-c3ccccc3C4(c3ccccc3)c3ccccc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.33
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL20345938 0.94 KDM4E (0.31) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL17816767 0.94 PDK2 (0.34) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL20345939 0.94 PDK2 (0.34) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL20345943 0.94 KDM4E (0.33) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL20345937 0.94 KDM4E (0.31) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL18469201 0.93 PDK2 (0.35) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL18468740 0.93 KDM4E (0.35) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL20345936 0.93 KDM4E (0.33) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL21239090 0.92 PDK2 (0.34) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL17854186 0.92 KDM4E (0.34) PDK2KDM4EMEN1LMNAMAPT

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-10854822-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2020-12-01 US disclosed
US-20180190904-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2018-07-05 US disclosed
US-20180190904-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2018-07-05 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 (2 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-20180190904-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE ESR1, L1CAM, ELAVL1 PDK2 2381/4885KDM4E 864/4885MEN1 349/4885
US-10854822-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic device ESR1, L1CAM, ELAVL1 PDK2 2381/4885KDM4E 864/4885MEN1 349/4885

“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.