SCHEMBL21889575

SCHEMBL21889575

CCCOc1ccc(N=Nc2ccc(C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.51
PPARD Q03181 1/20 0.49
PPARA Q07869 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
MAPT P10636 2/20 0.49
THRB P10828 1/20 0.49
CHRNA7 P36544 1/20 0.49
CHRNA10 Q9GZZ6 1/20 0.49
CHRNA9 Q9UGM1 1/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
DRD2 P14416 3/20 0.47
DRD4 P21917 3/20 0.47
DRD3 P35462 3/20 0.47
LTA4H P09960 1/20 0.47
PTGS1 P23219 1/20 0.45
PTGS2 P35354 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44

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
SCHEMBL17879709 1.00 CYP2C9 (0.51) CYP2C9PPARDPPARAL3MBTL1MAPT
SCHEMBL31542562 0.92 DRD2 (0.52) CYP2C9PPARDPPARAL3MBTL1CHRNA7
SCHEMBL18405978 0.92 DRD2 (0.52) CYP2C9PPARDPPARAL3MBTL1CHRNA7
SCHEMBL28964336 0.92 CYP2C9 (0.58) CYP2C9PPARAL3MBTL1MAPTCHRNA7
SCHEMBL28964335 0.92 CYP2C9 (0.58) CYP2C9PPARAL3MBTL1MAPTCHRNA7
SCHEMBL18179720 0.90 PPARA (0.52) PPARDPPARAL3MBTL1MAPTCHRNA7
SCHEMBL21391255 0.90 PPARA (0.52) PPARDPPARAL3MBTL1MAPTCHRNA7
SCHEMBL255419 0.88 DRD2 (0.57) L3MBTL1MAPTTHRBMEN1KMT2A
SCHEMBL18405940 0.87 NR5A1 (0.56) CYP2C9MAPTDRD2DRD4DRD3
SCHEMBL31542570 0.87 NR5A1 (0.56) CYP2C9MAPTDRD2DRD4DRD3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11143898-B2 Multicolor liquid crystal writing device WICUE, INC. (US) 2021-10-12 US disclosed
US-20200089036-A1 MULTICOLOR LIQUID CRYSTAL WRITING DEVICE WICUE USA INC. 2020-03-19 US disclosed