SCHEMBL21183244

SCHEMBL21183244

CSc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 6/20 0.44
TSHR P16473 4/20 0.44
ALOX12 P18054 1/20 0.43
QPCT Q16769 1/20 0.40
NOX1 Q9Y5S8 1/20 0.39
ACHE P22303 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SLC6A4 P31645 3/20 0.38
EGFR P00533 1/20 0.37
PDGFRB P09619 1/20 0.37
KDR P35968 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL12533886 0.94 MEN1 (0.42) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL24134022 0.94 ALDH1A1 (0.44) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL23051049 0.90 ALDH1A1 (0.40) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL76792 0.84
SCHEMBL12533890 0.83 NISCH (0.42) ALDH1A1NOX1SLC6A4PTGS2
SCHEMBL24133973 0.83 ALDH1A1 (0.46) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL8943645 0.83 ALDH1A1 (0.46) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL23967645 0.82 ALDH1A1 (0.46) MEN1KMT2AMAPTNPC1RAB9A
Hydrochloric Acid SCHEMBL7990919 0.82 MEN1 (0.54) MEN1KMT2AMAPTNPC1RAB9A
Water SCHEMBL27813433 0.82 MEN1 (0.54) MEN1KMT2AMAPTNPC1RAB9A

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-1894261-B1 ARYLAMINE- AND FLUORENE- POLYMERS FOR OLED DISPLAYS CAMBRIDGE DISPLAY TECH LTD (GB) 2019-07-24 EP disclosed