SCHEMBL23637362

SCHEMBL23637362

CC1(C)c2ccccc2-c2c(Cl)cc(C3(c4ccc5ccccc5c4)c4ccccc4-c4ccccc43)cc21

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
OPRK1 P41145 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDK2 Q15119 7/20 0.34
DHFR P00374 2/20 0.32
TYMS P04818 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
SLC6A2 P23975 1/20 0.32
KDM1A O60341 2/20 0.32
RCOR1 Q9UKL0 2/20 0.32
PGR P06401 1/20 0.30

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
SCHEMBL23637499 0.85 MEN1 (0.39) ESR1ESR2KDM4EMEN1LMNA
SCHEMBL30851345 0.78 MEN1 (0.53) ESR1ESR2KDM4EMEN1LMNA
SCHEMBL9974968 0.78 MEN1 (0.53) ESR1ESR2KDM4EMEN1LMNA
SCHEMBL23637431 0.75 MEN1 (0.44) ESR1ESR2KDM4EMEN1LMNA
SCHEMBL23637444 0.75 MEN1 (0.32) KDM4EMEN1LMNAMAPTKMT2A
SCHEMBL29369861 0.73 MEN1 (0.53) ESR1ESR2KDM4EMEN1LMNA
SCHEMBL16871337 0.73 PDK2 (0.57) PDK2SLC6A4SLC6A2PGR
SCHEMBL29809731 0.73 PDK2 (0.57) PDK2SLC6A4SLC6A2PGR
SCHEMBL28789120 0.73 MEN1 (0.53) ESR1ESR2KDM4EMEN1LMNA
SCHEMBL18386624 0.71 SLC6A4 (0.41) ESR1ESR2SLC6A4SLC6A3SLC6A2

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
WO-2021141356-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-07-15 WO disclosed