SCHEMBL21763155

SCHEMBL21763155

Brc1ccc(C2(c3ccccc3)c3ccccc3[C@]3(c4ccccc4)c4ccccc4-c4cccc2c43)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
OPRK1 P41145 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
POLB P06746 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
CFTR P13569 1/20 0.36
GOPC Q9HD26 1/20 0.36
PDK2 Q15119 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPK1 P28482 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL19735703 1.00 MEN1 (0.50) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL19735672 1.00 MEN1 (0.50) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL29506706 0.91 MEN1 (0.59) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL283196 0.91 MEN1 (0.59) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL17816646 0.89 MEN1 (0.57) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL105865 0.87 MEN1 (0.63) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL30288909 0.87 MEN1 (0.63) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL28135141 0.87 MEN1 (0.63) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL19735693 0.87 LMNA (0.43) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL19735694 0.87 LMNA (0.43) MEN1KMT2ALMNAKDM4EMAPT

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
EP-3369719-B1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2020-02-26 EP disclosed