SCHEMBL22878699

SCHEMBL22878699

c1ccc2c3c(ccc2c1)CN(c1ccncc1)Cc1ccc2ccccc2c1-3

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EED O75530 1/20 0.49
CHKA P35790 1/20 0.39
HRH1 P35367 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
ADRB2 P07550 1/20 0.36
NCF1 P14598 1/20 0.36
PLD1 Q13393 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL6591115 0.77 EED (0.75) EEDCHKAMEN1GAAKMT2A
SCHEMBL868639 0.72 TSHR (0.52) ALDH1A1MAPT
SCHEMBL29716676 0.72 TSHR (0.52) ALDH1A1MAPT
SCHEMBL21385140 0.70 TSHR (0.50) ALDH1A1MAPT
SCHEMBL19797772 0.68 TMEM97 (0.40) HRH3MEN1KMT2AALDH1A1MAPT
SCHEMBL12426595 0.68 MEN1 (0.43) HRH3MEN1KMT2AALDH1A1MAPT
SCHEMBL13203251 0.67 TMPRSS2 (0.53) ALDH1A1LMNAMAPT
SCHEMBL6441852 0.66 EED (1.00) EEDMEN1KMT2A
SCHEMBL17123068 0.66 MAPT (0.42) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL12599868 0.66 CYP1A2 (0.49) MEN1KMT2AALDH1A1LMNANPC1

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-20210013412-A1 PHOTOELECTRIC CONVERSION ELEMENT AND PHOTOELECTRIC CONVERSION ELEMENT MODULE RICOH COMPANY, LTD. (JP) 2021-01-14 US disclosed