Methylparaben

Methylparaben

SCHEMBL6315862

COC(=O)c1ccc(O)cc1.[PbH2]

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.95
CA2 P00918 8/20 0.95
CA12 O43570 5/20 0.95
CA7 P43166 5/20 0.95
CA9 Q16790 5/20 0.95
CA14 Q9ULX7 5/20 0.95
ALDH1A1 P00352 4/20 0.67
LMNA P02545 1/20 0.67
GAA P10253 1/20 0.67
TDP1 Q9NUW8 2/20 0.64
TSHR P16473 2/20 0.60
MAPT P10636 2/20 0.57
ESR1 P03372 2/20 0.57
XDH P47989 1/20 0.57
ESR2 Q92731 1/20 0.57
LOXL2 Q9Y4K0 1/20 0.55
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CHRM1 P11229 1/20 0.53
SLC6A2 P23975 1/20 0.53

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 SCHEMBL4440 0.98 CA1 (1.00) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL321534 0.98 CA1 (1.00) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL48757 0.95 CA1 (0.95) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL21274302 0.95 CA1 (0.95) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL1699480 0.95 CA1 (0.95) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL475867 0.95 CA1 (0.95) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL16029235 0.95 CA1 (0.95) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL8779118 0.95 CA1 (0.95) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL2810862 0.95 CA1 (0.95) CA1CA2CA12CA7CA9
Methylparaben SCHEMBL31713879 0.95 CA1 (0.95) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884763-B2 Waterless hand cleaner containing plant derived natural essential oil PERMATEX, INC. (US) 2005-04-26 US disclosed
EP-1450759-A2 WATERLESS HAND CLEANER CONTAINING NATURAL ESSENTIAL OIL Permatex, Inc. (US) 2004-09-01 EP disclosed
WO-2003037270-A2 WATERLESS HAND CLEANER CONTAINING NATURAL ESSENTIAL OIL ADVANCED CHEMISTRY AND TECHNOLOGY, INC. (US) 2003-05-08 WO disclosed
US-20030083212-A1 Waterless hand cleaner containing natural essential oil ADVANCED CHEMISTRY AND TECHNOLOGY, INC. 2003-05-01 US disclosed