SCHEMBL6904734

SCHEMBL6904734

O=C1c2ccccc2C(Cl)c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CDC25B P30305 1/20 0.52
EDNRB P24530 4/20 0.50
EDNRA P25101 4/20 0.50
S100A4 P26447 3/20 0.48
MAPK1 P28482 2/20 0.47
CYP1A2 P05177 1/20 0.47
IDO1 P14902 1/20 0.44
DNMT1 P26358 1/20 0.44
DNMT3L Q9UJW3 1/20 0.44
DNMT3A Q9Y6K1 1/20 0.44
MAOA P21397 2/20 0.43
APAF1 O14727 2/20 0.43
TDP2 O95551 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CES2 O00748 1/20 0.43
TERT O14746 1/20 0.43
NPC1 O15118 1/20 0.43
PLIN1 O60240 1/20 0.43

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
SCHEMBL29006544 0.86 S100A4 (0.50) MEN1KMT2ACDC25BEDNRBEDNRA
SCHEMBL31266545 0.84 GPR3 (0.46) MEN1KMT2AS100A4CYP1A2BCHE
SCHEMBL5343918 0.84 GPR3 (0.46) MEN1KMT2AS100A4CYP1A2BCHE
Hydrochloric Acid SCHEMBL29281106 0.81 GPR3 (0.44) MEN1KMT2AS100A4CYP1A2BCHE
SCHEMBL6905334 0.80 CACNB4 (0.41) MEN1KMT2ACDC25BEDNRBEDNRA
SCHEMBL9122030 0.80 ADORA2A (0.43) EDNRBEDNRAS100A4MAPK1CYP1A2
SCHEMBL6903914 0.79 MAPK1 (0.67) MEN1KMT2ACDC25BEDNRBEDNRA
SCHEMBL11143442 0.79 EDNRB (0.39) MEN1KMT2ACDC25BEDNRBEDNRA
SCHEMBL11143448 0.79 EDNRB (0.39) MEN1KMT2ACDC25BEDNRBEDNRA
SCHEMBL6901219 0.75 CDC25B (0.52) MEN1KMT2ACDC25BEDNRBEDNRA

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-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed
US-20020032256-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-14 US disclosed