SCHEMBL13839612

SCHEMBL13839612

O=C1c2cccc(OP(Oc3cccnc3)Oc3cccnc3)c2C(=O)c2c(OP(Oc3cccnc3)Oc3cccnc3)cccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 1/20 0.39
▸ LMNA P02545 4/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.36
▸ MAOA P21397 2/20 0.36
▸ MAOB P27338 2/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ EGFR P00533 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ ELANE P08246 3/20 0.35
▸ HTT P42858 3/20 0.35
▸ HPGD P15428 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ TDP2 O95551 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33

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
SCHEMBL13839589 0.84 ALDH1A1 (0.36) LMNATDP1MEN1MAPTKMT2A
SCHEMBL13839613 0.82 KCNA3 (0.51) KCNA3LMNATDP1MEN1MAPT
SCHEMBL1449085 0.76 LMNA (0.54) LMNATDP1ALDH1A1SMN1; SMN2HTT
SCHEMBL13839611 0.73 KCNA3 (0.40) KCNA3LMNATDP1MEN1MAPT
SCHEMBL13839608 0.73 ALDH1A1 (0.43) KCNA3LMNAMEN1MAPTKMT2A
SCHEMBL13839491 0.72 ALDH1A1 (0.47) LMNATDP1MEN1MAPTKMT2A
SCHEMBL13839600 0.72 ELANE (0.49) KCNA3LMNAMEN1MAPTKMT2A
SCHEMBL13839601 0.72 KCNA3 (0.43) KCNA3LMNATDP1MEN1MAPT
SCHEMBL13839610 0.72 EGFR (0.54) LMNATDP1MEN1MAPTKMT2A
SCHEMBL13839607 0.71 ALDH1A1 (0.52) KCNA3LMNATDP1MEN1MAPT

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-7531682-B2 Method for making nitrile compounds from ethylenically unsaturated compounds RHODIA POLYAMIDE INTERMEDIATES (FR) 2009-05-12 — — US disclosed
US-7531682-B2 Method for making nitrile compounds from ethylenically unsaturated compounds RHODIA POLYAMIDE INTERMEDIATES (FR) 2009-05-12 — — US disclosed
US-7253298-B2 Hydrocyanating an unsaturated aliphatic nitrile, or a linear pentenenitrile in a liquid medium with hydrogen cyanide in the presence of a Nickel catalyst with an triaryl phosphite ligand; isomerization RHODIA POLYAMIDE INTERMEDIATES (FR) 2007-08-07 — — US disclosed
US-7253298-B2 Hydrocyanating an unsaturated aliphatic nitrile, or a linear pentenenitrile in a liquid medium with hydrogen cyanide in the presence of a Nickel catalyst with an triaryl phosphite ligand; isomerization RHODIA POLYAMIDE INTERMEDIATES (FR) 2007-08-07 — — US disclosed
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