Paraben

Paraben

SCHEMBL4654906

Cc1c(O)ccc2c1O2.O=C(O)c1ccc(O)cc1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.52
CA12 O43570 2/20 0.52
CA1 P00915 2/20 0.52
CA4 P22748 2/20 0.52
CA6 P23280 2/20 0.52
CA7 P43166 2/20 0.52
CA9 Q16790 2/20 0.52
CA14 Q9ULX7 2/20 0.52
TYR P14679 2/20 0.52
CA3 P07451 1/20 0.52
DRD1 P21728 1/20 0.52
CA5A P35218 1/20 0.52
CA5B Q9Y2D0 1/20 0.52
SRD5A2 P31213 3/20 0.47
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 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
Phenol SCHEMBL5049852 0.81 CA12 (0.42) CA2CA12CA1CA4CA9
Phenol SCHEMBL28146909 0.81 CA12 (0.42) CA2CA12CA1CA4CA9
SCHEMBL33480 0.80
Urea SCHEMBL27878783 0.79 ESR2 (0.37) TYRALDH1A1SMN1; SMN2KDM4EMAPT
Formaldehyde SCHEMBL9717809 0.79 ESR2 (0.39) TYRALDH1A1SMN1; SMN2KDM4EGAA
SCHEMBL30301367 0.78 ESR2 (0.41) TYRALDH1A1SMN1; SMN2KDM4EGAA
Urea SCHEMBL27402617 0.76 ESR2 (0.35) TYRALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL7218349 0.73 ACHE (0.41) TYRALDH1A1MAPTHPGDESR1
Paraben SCHEMBL1685428 0.72 CA2 (0.89) CA2CA12CA1CA4CA6
Paraben SCHEMBL27392236 0.72 CA2 (0.89) CA2CA12CA1CA4CA6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1470446-A4 ORGANIC ANTI-REFLECTIVE COATING COMPOSITIONS FOR ADVANCED MICROLITHOGRAPHY BREWER SCIENCE INC (US) 2008-01-23 EP disclosed
EP-1470446-A1 ORGANIC ANTI-REFLECTIVE COATING COMPOSITIONS FOR ADVANCED MICROLITHOGRAPHY Brewer Science, Inc. (US) 2004-10-27 EP disclosed
WO-2003067329-A1 ORGANIC ANTI-REFLECTIVE COATING COMPOSITIONS FOR ADVANCED MICROLITHOGRAPHY BREWER SCIENCE, INC. (US) 2003-08-14 WO disclosed