SCHEMBL6200077

SCHEMBL6200077

NOCc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 11/20 0.67
AGXT P21549 8/20 0.64
LTA4H P09960 3/20 0.57
TSHR P16473 1/20 0.52
NR1H2 P55055 1/20 0.52
BAX Q07812 1/20 0.52
MAOA P21397 1/20 0.52
CYP3A4 P08684 1/20 0.50

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
Hydrochloric Acid SCHEMBL7236178 0.98 AGXT (0.68) IDO1AGXTLTA4HTSHRNR1H2
SCHEMBL8994543 0.82 TSHR (0.64) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL1715197 0.82 IDO1 (0.65) IDO1AGXTCYP3A4
SCHEMBL7948 0.81
SCHEMBL20469087 0.81 IDO1 (1.00) IDO1AGXTTSHRCYP3A4
SCHEMBL12311482 0.81 IDO1 (0.71) IDO1AGXTLTA4HMAOA
Hydrochloric Acid SCHEMBL9716600 0.80 IDO1 (0.66) IDO1AGXTLTA4HCYP3A4
SCHEMBL891493 0.80 FFAR1 (0.69) LTA4HMAOA
Bromide SCHEMBL8996427 0.79 IDO1 (0.94) IDO1AGXTTSHRCYP3A4
SCHEMBL8863651 0.79 IDO1 (0.94) IDO1AGXTTSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7312200-B2 9-ketospinosyn derivatives BAYER CROPSCIENCE AG (DE) 2007-12-25 US disclosed
US-7312200-B2 9-ketospinosyn derivatives BAYER CROPSCIENCE AG (DE) 2007-12-25 US disclosed
EP-1266887-B1 Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-08-17 EP disclosed
CN-1390834-A Indenoindolone compounds, their preparation and medicinal compositions containing them SEUVILE LAB (FR) 2003-01-15 CN disclosed
EP-1266887-A2 Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2002-12-18 EP disclosed
EP-0015456-B1 OMEGA-HALOGENO-ACETOPHENONE OXIME ETHERS, PREPARATION THEREOF AND THEIR USE AS INTERMEDIATES IN THE PREPARATION OF OMEGA-AZOLYL-ACETOPHENONE OXIME ETHERS BAYER AG (DE) 1981-12-02 EP disclosed
US-4293715-A FUNGICIDES, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-10-06 US disclosed