SCHEMBL2811654

SCHEMBL2811654

CCCCCCCCCCCCCCCCCCc1ccc2ccc3c(CCCCCCCCCCCCCCCCCC)ccc4ccc1c2c43

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPT P10636 3/20 0.46
CYP3A4 P08684 3/20 0.46
TYR P14679 2/20 0.46
TP53 P04637 2/20 0.46
ALOX5 P09917 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LIPG Q9Y5X9 1/20 0.43
KCNH2 Q12809 2/20 0.42
TLR8 Q9NR97 5/20 0.40
ESR1 P03372 2/20 0.38
ADRA2A P08913 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
TACR2 P21452 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38

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
SCHEMBL2817401 1.00 MEN1 (0.49) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL2817093 1.00 MEN1 (0.49) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL8684572 0.93 MEN1 (0.59) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL30345593 0.93 MEN1 (0.59) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL9445539 0.93 MEN1 (0.59) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL4585929 0.93 MEN1 (0.59) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL9058783 0.93 MEN1 (0.59) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL9299020 0.93 MEN1 (0.59) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL9931458 0.93 MEN1 (0.59) MEN1KMT2AMAPTCYP3A4TYR
SCHEMBL28012082 0.93 MEN1 (0.59) MEN1KMT2AMAPTCYP3A4TYR

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-20100249319-A1 POLYMER COMPOUND, METHOD FOR PRODUCING THE SAME, AND COMPOSITION CONTAINING THE POLYMER COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-30 US disclosed
EP-2208745-A1 POLYMER COMPOUND, METHOD FOR PRODUCING THE SAME, AND COMPOSITION CONTAINING THE POLYMER COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-07-21 EP disclosed