SCHEMBL9750049

SCHEMBL9750049

O=C(OCc1ccc(Cl)cc1Cl)c1cc(O)c(O)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.66
MEN1 O00255 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
PKM P14618 1/20 0.53
CYP2C19 P33261 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
SERPINE1 P05121 5/20 0.51
NR4A2 P43354 2/20 0.49
GAA P10253 1/20 0.49
TYR P14679 2/20 0.48
IDO1 P14902 2/20 0.46
NR4A1 P22736 1/20 0.46
NR4A3 Q92570 1/20 0.46

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
SCHEMBL9750015 0.84 TYR (0.58) L3MBTL1TDP1SERPINE1TYR
SCHEMBL6666901 0.82 L3MBTL1 (0.74) L3MBTL1MEN1CYP1A2CYP2D6CYP2C9
SCHEMBL9749615 0.80 TYR (0.59) L3MBTL1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL8581278 0.76 L3MBTL1 (0.61) L3MBTL1MEN1CYP1A2CYP2D6CYP2C9
SCHEMBL3292219 0.76 L3MBTL1 (0.60) L3MBTL1MEN1CYP1A2CYP2D6CYP2C9
SCHEMBL4734719 0.75 TYR (0.72) L3MBTL1SERPINE1TYR
SCHEMBL27997536 0.75 L3MBTL1 (0.71) L3MBTL1MEN1CYP1A2CYP2D6CYP2C9
SCHEMBL11888397 0.74 GAA (0.64) L3MBTL1MEN1CYP1A2CYP2D6CYP2C9
SCHEMBL116267 0.74 IDO1 (0.59) L3MBTL1MEN1CYP1A2CYP2D6CYP2C9
SCHEMBL8743487 0.73 L3MBTL1 (0.57) L3MBTL1MEN1CYP1A2CYP2D6CYP2C9

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-5084593-A Cyanine, aniline dyes for heat sensitive recording elements RICOH COMPANY, LTD. (JP) 1992-01-28 US disclosed
US-5008238-A Thermosensitive material with phenolic developer RICOH COMPANY, LTD. (JP) 1991-04-16 US disclosed