SCHEMBL10032268

SCHEMBL10032268

c1ccc2cc(-c3ccc4ccc5ccc(-c6cccc7c(-c8ccc9ccc%10ccc(-c%11ccc%12ccccc%12c%11)nc%10c9n8)cccc67)nc5c4n3)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.47
CYP1A2 P05177 3/20 0.45
MAOB P27338 1/20 0.44
AR P10275 5/20 0.43
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
NFKB1 P19838 1/20 0.42
RAB9A P51151 1/20 0.42
GFER P55789 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
CYP1A1 P04798 1/20 0.42
CYP1B1 Q16678 1/20 0.42

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
SCHEMBL17174051 0.95 PIM1 (0.49) PIM1CYP1A2MAOBARALDH1A1
SCHEMBL10032266 0.95 CYP1A2 (0.46) PIM1CYP1A2MAOBARALDH1A1
SCHEMBL10032460 0.94 PIM1 (0.49) PIM1CYP1A2MAOBARALDH1A1
SCHEMBL10032298 0.94 PIM1 (0.48) PIM1CYP1A2MAOBARALDH1A1
SCHEMBL17174045 0.90 PIM1 (0.45) PIM1CYP1A2MAOBARALDH1A1
SCHEMBL17174049 0.89 PIM1 (0.43) PIM1CYP1A2ARALDH1A1SMN1; SMN2
SCHEMBL19767984 0.88 ERN1 (0.45) PIM1NPC1RAB9ACYP11B1CYP11B2
SCHEMBL30414157 0.88 CYP1A2 (0.55) CYP1A2MAOBARALDH1A1SMN1; SMN2
SCHEMBL16542814 0.88 CYP1A2 (0.55) CYP1A2MAOBARALDH1A1SMN1; SMN2
SCHEMBL10032286 0.87 AR (0.43) PIM1ARALDH1A1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114529-B2 Material for lighting emitting device and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-14 US disclosed
US-8114529-B2 Material for lighting emitting device and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-14 US disclosed
US-20070267958-A1 Material for Light Emitting Device and Light Emitting Device TORAY INDUSTRIES, INC. (JP) 2007-11-22 US disclosed
US-20070267958-A1 Material for Light Emitting Device and Light Emitting Device TORAY INDUSTRIES, INC. (JP) 2007-11-22 US disclosed