SCHEMBL8943874

SCHEMBL8943874

COc1ccc(N(c2ccccc2)c2ccccc2)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.48
EP300 Q09472 1/20 0.47
KAT8 Q9H7Z6 1/20 0.47
IMPDH2 P12268 1/20 0.44
IMPDH1 P20839 1/20 0.44
NQO1 P15559 1/20 0.42
CDC25B P30305 3/20 0.41
MAPT P10636 3/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PLK1 P53350 1/20 0.40
TUBB3 Q13509 1/20 0.40
HPGDS O60760 1/20 0.39
CYP2C9 P11712 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
STAT6 P42226 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL9162210 0.91 IDO1 (0.50) IDO1EP300KAT8IMPDH2IMPDH1
SCHEMBL10110902 0.82 ALDH1A1 (0.44) EP300KAT8MAPTHTTNPSR1
SCHEMBL17999996 0.80 SLC16A3 (0.42) MAPTCYP2C9ALDH1A1CYP1A2CYP3A4
SCHEMBL12888139 0.80 ALDH1A1 (0.42) EP300KAT8MAPTHTTNPSR1
SCHEMBL18000005 0.78 TSHR (0.46) NPSR1ALDH1A1
SCHEMBL8943743 0.78 SMN1; SMN2 (0.44) IDO1MAPTTUBB3ALDH1A1
SCHEMBL30143822 0.78 SMN1; SMN2 (0.44) IDO1MAPTTUBB3ALDH1A1
SCHEMBL4887896 0.78 ALDH1A1 (0.52) EP300KAT8MAPTLMNAHTT
SCHEMBL29949968 0.77 KEAP1 (0.32) MAPTLMNAHTTALDH1A1
SCHEMBL2535094 0.77 KEAP1 (0.45) MAPTLMNATUBB3EGFR

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-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed