SCHEMBL10840202

SCHEMBL10840202

CCOC(=O)NCCOC(=O)C(C)Oc1ccc(Oc2cnc3cc(F)ccc3n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.44
▸ LMNA P02545 3/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ CYP3A4 P08684 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ GMNN O75496 1/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ PMP22 Q01453 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ GAA P10253 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 4/20 0.41
▸ HTT P42858 3/20 0.39
▸ MEN1 O00255 3/20 0.39

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
SCHEMBL10838995 0.93 MAPT (0.45) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL10839016 0.90 MAPT (0.57) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL8508358 0.89 ALDH1A1 (0.51) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL10839775 0.88 GAA (0.43) MAPTCYP1A2CYP3A4TP53ALOX15
SCHEMBL10969382 0.85 ALDH1A1 (0.48) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL10840123 0.85 MAPT (0.46) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL733453 0.83 MAPT (0.53) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL10881162 0.83 ALDH1A1 (0.47) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL10967029 0.82 ALDH1A1 (0.45) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL10839872 0.82 MAPT (0.59) MAPTLMNACYP1A2CYP3A4ALDH1A1

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-4582526-A Carbamic acid ester herbicides HOFFMANN-LA ROCHE INC. (US) 1986-04-15 — — US claimed
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