SCHEMBL6340784

SCHEMBL6340784

COCCOc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.66
TTR P02766 1/20 0.49
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 2/20 0.47
MAPT P10636 6/20 0.47
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
ALDH1A1 P00352 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
KDM4E B2RXH2 1/20 0.47
USP2 O75604 1/20 0.47
DUSP3 P51452 1/20 0.47
EGFR P00533 3/20 0.46
PIM1 P11309 1/20 0.46
MAPK1 P28482 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
PABPC1 P11940 1/20 0.44
NSD2 O96028 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL6341126 0.95 KCNA3 (0.61) KCNA3TTRRAB9ASMN1; SMN2NPC1
SCHEMBL6340561 0.95 KCNA3 (0.61) KCNA3TTRRAB9ASMN1; SMN2NPC1
SCHEMBL6334031 0.95 KCNA3 (0.61) KCNA3TTRRAB9ASMN1; SMN2NPC1
SCHEMBL15302481 0.90 KCNA3 (0.54) KCNA3TTRRAB9ASMN1; SMN2NPC1
SCHEMBL30860097 0.90 KCNA3 (0.54) KCNA3TTRRAB9ASMN1; SMN2NPC1
SCHEMBL19881689 0.88 KCNA3 (0.53) KCNA3TTRRAB9ASMN1; SMN2NPC1
SCHEMBL10812034 0.86 ADORA2A (0.51) KCNA3TTRRAB9ASMN1; SMN2NPC1
SCHEMBL28986871 0.84 KCNA3 (0.70) KCNA3TTRRAB9ASMN1; SMN2NPC1
SCHEMBL9445860 0.84 KCNA3 (0.91) KCNA3TTRRAB9ASMN1; SMN2MAPT
SCHEMBL11800251 0.84 EGFR (0.56) KCNA3TTRRAB9ASMN1; SMN2MAPT

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-6949250-B2 Selective algaecides for control of cyanochloronta THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2005-09-27 US disclosed
WO-2004060061-A1 NOVEL SELECTIVE ALGAECIDES FOR CONTROL OF CYANOCHLORONTA THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2004-07-22 WO disclosed
US-20040116536-A1 Novel selective algaecides for control of cyanochloronta UNIVERSITY OF MISSISSIPPI, THE 2004-06-17 US disclosed
US-5241107-A Antitumor agents BURROUGHS WELLCOME CO. (US) 1993-08-31 US disclosed