SCHEMBL2355103

SCHEMBL2355103

COc1ccc(Cc2ccc(Cc3ccccc3)c3ccccc23)cc1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.71
MAOB P27338 1/20 0.54
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50
SIGMAR1 Q99720 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
KDR P35968 1/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL4457613 0.88 LTA4H (0.55) LTA4HMAOBCYP11B1CYP11B2SIGMAR1
SCHEMBL570480 0.84 LTA4H (1.00) LTA4HSIGMAR1MEN1KMT2AHTT
SCHEMBL28251912 0.82 LTA4H (0.72) LTA4HMAOBCYP11B1CYP11B2MEN1
SCHEMBL20930937 0.81 CYP2C9 (0.60) MEN1KMT2ALMNAMAPTHTT
Nitrogen SCHEMBL28594721 0.80 LTA4H (0.91) LTA4HSIGMAR1MEN1KMT2AHTT
SCHEMBL2027109 0.80 LTA4H (0.69) LTA4HMAOBCYP11B1CYP11B2MEN1
SCHEMBL5551078 0.79 LTA4H (0.88) LTA4HMAOBSIGMAR1MEN1KMT2A
SCHEMBL984055 0.79 LTA4H (0.67) LTA4HMAOBCYP11B1CYP11B2SIGMAR1
SCHEMBL383153 0.78 MEN1 (0.52) LTA4HMAOBCYP11B1CYP11B2MEN1
SCHEMBL12869627 0.78 LTA4H (0.60) LTA4HMAOBCYP11B1CYP11B2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013126034-A1 SYNTHESIS OF HIGH PURITY DMT-C3-DISULFIDE PHOSPHORAMIDITE CHEMGENES CORPORATION (US) 2013-08-29 WO claimed
EP-2560982-A2 PHOSPHORAMIDITES FOR SYNTHETIC RNA IN THE REVERSE DIRECTION Chemgenes Corporation (US) 2013-02-27 EP disclosed
WO-2011103468-A2 PHOSPHORAMIDITES FOR SYNTHETIC RNA IN THE REVERSE DIRECTION CHEMGENES CORPORATION (US) 2011-08-25 WO disclosed