SCHEMBL28615796

SCHEMBL28615796

CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc2c4ccccc4c4ccccc4c12)c1ccccc1C3(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PGR P06401 5/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
KDM4E B2RXH2 2/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 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
SCHEMBL21315863 0.91 PGR (0.36) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL21315859 0.90 PGR (0.33) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL28614499 0.88 MEN1 (0.34) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL21315872 0.88 PGR (0.35) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL28623453 0.87 POLB (0.43) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL28623452 0.85 MEN1 (0.38) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL21315865 0.85 PGR (0.36) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL21514446 0.85 PGR (0.36) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL21324332 0.85 PGR (0.36) PGRKMT2AMEN1KDM4EMAPT
SCHEMBL21514285 0.85 PGR (0.33) PGRKMT2AMEN1KDM4EMAPT

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
CN-110218185-B Heteroaromatic compound and organic electroluminescent module using the same 机光科技股份有限公司 2021-08-10 CN disclosed