SCHEMBL11210532

SCHEMBL11210532

CCOC(=O)CCc1cc(OC)cc(N)c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 2/20 0.44
▸ CYP4A11 Q02928 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HPGD P15428 3/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ DPP4 P27487 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ TNF P01375 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NPC1 O15118 1/20 0.38

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
SCHEMBL11212844 0.87 POLB (0.40) SMN1; SMN2TDP1POLBALDH1A1GAA
SCHEMBL11213302 0.86 SMN1; SMN2 (0.43) SMN1; SMN2TDP1L3MBTL1HPGDCYP3A4
SCHEMBL11220278 0.82 CYP4F2 (0.46) CYP4F2CYP4A11HPGDDPP4POLB
Hydrochloric Acid SCHEMBL6983711 0.81 CYP4F2 (0.48) CYP4F2CYP4A11SMN1; SMN2TDP1HPGD
SCHEMBL11210138 0.80 CYP4F2 (0.43) CYP4F2CYP4A11HPGDDPP4POLB
SCHEMBL6036442 0.77 POLB (0.56) CYP4F2CYP4A11TDP1L3MBTL1HPGD
SCHEMBL491048 0.76 CYP1A2 (0.55) CYP4F2CYP4A11SMN1; SMN2DPP4ALDH1A1
SCHEMBL11214621 0.75 CYP4F2 (0.59) CYP4F2CYP4A11SMN1; SMN2ALDH1A1GAA
SCHEMBL11212268 0.75 ALOX5 (0.55) CYP4F2CYP4A11ALDH1A1TNFKMT2A
SCHEMBL11214518 0.75 ALDH1A1 (0.46) SMN1; SMN2TDP1HPGDPOLBALDH1A1

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
EP-0081321-A1 2-Aminophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1983-06-15 — — EP disclosed
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