SCHEMBL25535780

SCHEMBL25535780

Cc1ccc(C)c(-c2ccc3ccc(-c4ccc(F)cc4)cc3[n+]2C)c1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 5/20 0.33
APP P05067 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
ACHE P22303 2/20 0.32
GRM2 Q14416 1/20 0.32
TNKS2 Q9H2K2 1/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A3 P47895 1/20 0.31
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
SCHEMBL25535791 0.91 ABL1 (0.35) ABL1APPNPC1RAB9AACHE
SCHEMBL25535783 0.85 PGR (0.32) ABL1TNKS2ALDH1A3PGR
SCHEMBL25535519 0.85 NR3C1 (0.39) NPC1ACHEPGR
SCHEMBL26780767 0.84 CYP2A6 (0.37) RAB9AMEN1KMT2A
SCHEMBL26781070 0.79 KDM4E (0.31) MEN1KMT2A
SCHEMBL25535941 0.78 ACHE (0.38) NPC1RAB9AACHEGRM2MEN1
SCHEMBL26301323 0.78
SCHEMBL25535793 0.77 ACHE (0.32) ABL1ACHETNKS2ALDH1A3PGR
SCHEMBL25536169 0.77 ABL1 (0.35) ABL1APPNPC1RAB9AGRM2
SCHEMBL25536160 0.77 ABL1 (0.38) ABL1APPNPC1RAB9AGRM2

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-20230157153-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-05-18 US disclosed