Butylparaben

Butylparaben

SCHEMBL5789201

CCCCOC(=O)c1ccc(O)cc1.CCCCOC(=O)c1ccc(O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 1.00
TSHR P16473 4/20 1.00
LMNA P02545 2/20 1.00
CYP1A2 P05177 2/20 1.00
CYP2C19 P33261 2/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
CYP2D6 P10635 1/20 1.00
MAPK1 P28482 1/20 1.00
NR1H2 P55055 1/20 1.00
RNASEL Q05823 1/20 1.00
ALDH1A1 P00352 2/20 0.79
TDP1 Q9NUW8 2/20 0.79
CHRM1 P11229 1/20 0.79
SLC6A2 P23975 1/20 0.79
KDR P35968 1/20 0.79
CYP3A4 P08684 1/20 0.72
CYP2C9 P11712 1/20 0.72
PDE4D Q08499 1/20 0.72
CA12 O43570 1/20 0.67
CA1 P00915 1/20 0.67

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
Butylparaben SCHEMBL3647 1.00 ESR1 (1.00) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL344001 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL29377478 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL27203944 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL761983 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL5152448 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL2325184 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL9172319 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL29376702 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19
Butylparaben SCHEMBL27996201 0.98 ESR1 (0.96) ESR1TSHRLMNACYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11062794-B2 Olfactory signature and odorant mixture having the same YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2021-07-13 US disclosed
US-20180253534-A1 OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-09-06 US disclosed
EP-1707156-B1 Antimicrobial indwelling voice prosthesis HELIX MEDICAL LLC (US) 2013-04-17 EP disclosed
WO-2013035070-A1 OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2013-03-14 WO disclosed
US-8317861-B2 Antimicrobial indwelling voice prosthesis HELIX MEDICAL, LLC (US) 2012-11-27 US disclosed
EP-1707156-A1 Antimicrobial indwelling voice prosthesis HELIX MEDICAL INC. (US) 2006-10-04 EP disclosed
US-20050256573-A1 Medical devices having antimicrobial properties FREUDENBERG MEDICAL, LLC 2005-11-17 US disclosed
US-20050171602-A1 Antimicrobial indwelling voice prosthesis FREUDENBERG MEDICAL, LLC 2005-08-04 US disclosed
US-20020193879-A1 Medical devices having antimicrobial properties HELIX MEDICAL, LLC 2002-12-19 US disclosed
WO-2002083031-A2 MEDICAL DEVICES HAVING ANTIMICROBIAL PROPERTIES HELIX MEDICAL, INC. (US) 2002-10-24 WO disclosed