SCHEMBL11048123

SCHEMBL11048123

CCCCCC1CCC(c2ccccc2-c2cc(O)c3c(c2N)C(=O)c2c(O)ccc(N)c2C3=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ PABPC1 P11940 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ CSNK1A1 P48729 1/20 0.41
▸ CSNK1D P48730 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ PLEC Q15149 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CSNK1G1 Q9HCP0 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ CSNK2A2 P19784 1/20 0.37
▸ CSNK2B P67870 1/20 0.37
▸ CSNK2A1 P68400 1/20 0.37
▸ CSNK2A3 Q8NEV1 1/20 0.37
▸ CES2 O00748 1/20 0.37
▸ NQO1 P15559 1/20 0.32
▸ ELANE P08246 2/20 0.32

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
SCHEMBL11048137 1.00 MEN1 (0.41) MEN1POLBPABPC1HPGDCSNK1A1
SCHEMBL11048152 0.84 CSNK2A2 (0.38) MEN1POLBPABPC1HPGDCSNK1A1
SCHEMBL11049024 0.76 MAOB (0.45) MEN1HPGDKMT2AMCL1SMN1; SMN2
SCHEMBL8416013 0.74 BCHE (0.44) MEN1HPGDKMT2ASMN1; SMN2
SCHEMBL11350506 0.72 MEN1 (0.64) MEN1POLBPABPC1HPGDCSNK1A1
SCHEMBL10882597 0.72 BCHE (0.41) MEN1HPGDKMT2ASMN1; SMN2
SCHEMBL10826226 0.72 ADORA2A (0.36) MEN1POLBPABPC1HPGDCSNK1A1
SCHEMBL10826224 0.72 ADORA2A (0.36) MEN1POLBPABPC1HPGDCSNK1A1
SCHEMBL28539185 0.70 CES2 (0.43) MEN1HPGDKMT2ASMN1; SMN2CES2
SCHEMBL1680058 0.70 CES2 (0.43) MEN1HPGDKMT2ASMN1; SMN2CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4456545-A Dichroitic anthraquinone dyestuffs useful in liquid crystalline dielectrics and electro-optical indicator elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-06-26 — — US disclosed
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