SCHEMBL23763566

SCHEMBL23763566

CC(C)(C)c1ccc2c(c1)c1c3c(c4c5cc(C(C)(C)C)ccc5n5c4c1n1c4ccc6c7ccccc7sc6c4nc51)n1c4ccc5c6ccccc6sc5c4nc1n23

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
MAPT P10636 1/20 0.33
KIF11 P52732 2/20 0.33
APEX1 P27695 1/20 0.32
PGR P06401 1/20 0.31
RORA P35398 1/20 0.31
RORC P51449 1/20 0.31
RORB Q92753 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TNF P01375 1/20 0.30
NOD1 Q9Y239 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
SCHEMBL23763593 0.88 TNKS (0.34) TNKSTNKS2MAPTKIF11APEX1
SCHEMBL23763572 0.86 TNKS (0.34) TNKSTNKS2KIF11APEX1PGR
SCHEMBL23763592 0.81 TNF (0.33) TNKSTNKS2KIF11APEX1PGR
SCHEMBL23763745 0.81 TNF (0.33) TNKSTNKS2KIF11APEX1PGR
SCHEMBL23763561 0.78 PGR (0.30) PGRRORARORCRORB
SCHEMBL23763591 0.78 TNF (0.32) TNKSTNKS2KIF11PGRRORA
SCHEMBL23763588 0.77 PIK3CD (0.32) MAPTKIF11PGRRORARORC
SCHEMBL23763736 0.76 PIK3CD (0.33) MAPTKIF11PGRRORARORC
SCHEMBL23763732 0.75 HTR1D (0.31)
SCHEMBL25682452 0.75 KIF11 (0.40) TNKSTNKS2MAPTKIF11APEX1

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-3865486-A1 HETEROCYCLIC COMPOUND AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE HETEROCYCLIC COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2021-08-18 EP disclosed