Methylparaben

Methylparaben

SCHEMBL28102722

COC(=O)c1ccc(O)cc1.O=[C]c1ccccc1

nearest known ligand 0.67

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.67
CA2 P00918 6/20 0.67
CA12 O43570 1/20 0.67
CA7 P43166 1/20 0.67
CA9 Q16790 1/20 0.67
CA14 Q9ULX7 1/20 0.67
TSHR P16473 1/20 0.58
MAPT P10636 4/20 0.53
RAB9A P51151 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
LMNA P02545 2/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
EGFR P00533 1/20 0.48

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
Methylparaben SCHEMBL28757100 0.86 CA1 (0.83) CA1CA2CA12CA7CA9
SCHEMBL99157 0.84 CA1 (0.59) CA1CA2CA12CA7CA9
Methyl Benzoate SCHEMBL9685679 0.84 TSHR (0.83) CA1CA2CA12CA7CA9
Phenol SCHEMBL8167350 0.84 CA1 (0.79) CA1CA2CA12CA7CA9
Biphenyl SCHEMBL27469149 0.82 CA1 (0.77) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL4440 0.82 CA1 (1.00) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL321534 0.82 CA1 (1.00) CA1CA2CA12CA7CA9
Methyl Benzoate SCHEMBL28393301 0.81 CA1 (0.74) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL8030878 0.81 CA1 (0.74) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL9480744 0.81 CA1 (0.74) CA1CA2CA12CA7CA9

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
CN-103091987-B Positive type photosensitive organic compound, the manufacture method of resist pattern, semiconductor device and electronic device 日立化成株式会社 2016-11-23 CN disclosed