SCHEMBL17854635

SCHEMBL17854635

c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 4/20 0.41
KDM4E B2RXH2 3/20 0.41
LMNA P02545 2/20 0.41
OPRK1 P41145 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PDK2 Q15119 4/20 0.41
POLB P06746 1/20 0.39
CYP1A2 P05177 2/20 0.34
TSHR P16473 1/20 0.34
MAPK14 Q16539 4/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
GAA P10253 2/20 0.31
GLA P06280 1/20 0.31
RECQL P46063 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
SCHEMBL22000735 0.99 MEN1 (0.41) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL17081261 0.99 MEN1 (0.41) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL20434441 0.91 PDK2 (0.41) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL23288331 0.91 PDK2 (0.37) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL18468778 0.91 PDK2 (0.37) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL21665665 0.90 MAPT (0.44) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL20871527 0.90 MEN1 (0.42) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL20871520 0.90 MAPT (0.49) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL17858842 0.90 MEN1 (0.38) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL22662298 0.90 PDK2 (0.38) MEN1KMT2AMAPTKDM4ELMNA

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-10944057-B2 Compound, material for organic electroluminescence devices, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2021-03-09 US disclosed
US-20160176801-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICES, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 US disclosed
US-20160176801-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICES, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 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-10944057-B2 Compound, material for organic electroluminescence devices, organic electroluminescence device, and electronic equipment OR10J3, KCNA5, KCNK10 MEN1 796/4885KMT2A 525/4885MAPT 2030/4885
US-20160176801-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICES, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT OR10J3, KCNA5, KCNK10 MEN1 796/4885KMT2A 525/4885MAPT 2030/4885

“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.