SCHEMBL3402079

SCHEMBL3402079

CCc1ccc(O[PH](=O)[O-])cc1.CCc1ccc(O[PH](=O)[O-])cc1.[Cu+2]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOD1 P00441 1/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ CA2 P00918 1/20 0.39
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ PLK1 P53350 1/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ NPC1 O15118 2/20 0.36
▸ PPARG P37231 1/20 0.36
▸ PPARA Q07869 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.35
▸ TP53 P04637 1/20 0.34

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
SCHEMBL1416703 0.81 SOD1 (0.47) SOD1SMN1; SMN2CYP2C19ALDH1A1LMNA
SCHEMBL213057 0.79 THRB (0.49) SMN1; SMN2ALDH1A1LMNACA2KMT2A
SCHEMBL4250545 0.78 SMN1; SMN2 (0.44) SOD1SMN1; SMN2CYP2C19ALDH1A1LMNA
SCHEMBL18037094 0.78 SMN1; SMN2 (0.47) SOD1SMN1; SMN2CYP2C19ALDH1A1LMNA
SCHEMBL988094 0.76 SMN1; SMN2 (0.42) SOD1SMN1; SMN2CYP2C19ALDH1A1LMNA
SCHEMBL3402078 0.76 SMN1; SMN2 (0.46) SOD1SMN1; SMN2CYP2C19ALDH1A1LMNA
SCHEMBL30229465 0.75 THRB (0.49) SMN1; SMN2ALDH1A1LMNACA2KMT2A
SCHEMBL672943 0.75 HTR2A (0.51) SMN1; SMN2ALDH1A1LMNACA2KMT2A
SCHEMBL28904253 0.75 THRB (0.49) SMN1; SMN2ALDH1A1LMNACA2KMT2A
SCHEMBL5554949 0.72 CA2 (0.43) SMN1; SMN2CYP2C19ALDH1A1LMNACA2

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
EP-1800885-B1 RECORDING MATERIAL AND METHOD OF RECORDING TOYO INK MFG CO (JP) 2010-08-11 — — EP disclosed
EP-1800885-A1 RECORDING MATERIAL AND METHOD OF RECORDING TOYO INK MFG. CO., LTD. (JP) 2007-06-27 — — EP disclosed
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