SCHEMBL23936198

SCHEMBL23936198

CC1(C)c2cc(-c3ccccc3)ccc2-c2c(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cccc2C1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 10/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
GLA P06280 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
NTSR1 P30989 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
PGR P06401 2/20 0.35
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34

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
SCHEMBL23936438 1.00 PDK2 (0.40) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936755 0.95 PDK2 (0.38) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936333 0.93 MEN1 (0.36) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936439 0.92 PDK2 (0.36) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936750 0.92 PDK2 (0.36) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936437 0.92 PDK2 (0.36) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936193 0.92 PDK2 (0.38) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936243 0.92 PDK2 (0.38) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936171 0.92 MEN1 (0.39) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23936127 0.92 L3MBTL1 (0.41) PDK2MEN1KMT2AALDH1A1MAPT

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
US-20210328150-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 US disclosed