SCHEMBL9106594

SCHEMBL9106594

CNC(=O)c1[c]ccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 2/20 0.54
ALDH1A1 P00352 3/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 2/20 0.42
PGR P06401 1/20 0.42
PTGS1 P23219 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HPGD P15428 1/20 0.40
HIF1A Q16665 1/20 0.40
BRD4 O60885 2/20 0.40
MMP3 P08254 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
MTNR1A P48039 2/20 0.39
YTHDC1 Q96MU7 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL7976244 0.83 GAA (0.45) PLK1ALDH1A1NPC1RAB9AKDM4E
SCHEMBL7308954 0.80 ALDH1A1 (0.44) PLK1ALDH1A1NPC1RAB9AKDM4E
SCHEMBL7517735 0.79 NCEH1 (0.43) PLK1ALDH1A1KDM4EGAAPGR
SCHEMBL2517773 0.78 NR4A1 (0.48) ALDH1A1NPC1RAB9AKDM4EGAA
SCHEMBL20507043 0.78 CYP1A2 (0.40) PLK1ALDH1A1NPC1RAB9AKDM4E
SCHEMBL1229740 0.77 KDM4E (0.43) ALDH1A1KDM4EGAAHSD17B10MMP3
SCHEMBL9298921 0.77 NR4A1 (0.38) PLK1ALDH1A1KDM4EGAAHSD17B10
SCHEMBL6228359 0.76 NPC1 (0.49) NPC1RAB9A
SCHEMBL6228430 0.76 FKBP5 (0.53) ALDH1A1NPC1RAB9AGAACYP1A2
Hydrochloric Acid SCHEMBL8169298 0.75 KDM4E (0.42) ALDH1A1KDM4EGAAHSD17B10MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11066749-B2 Corrosion inhibition of HCL treatment fluids with environmentally compatible solvent HALLIBURTON ENERGY SERVICES, INC. (US) 2021-07-20 US claimed
US-20200173034-A1 Corrosion Inhibition of HCL Treatment Fluids with Environmentally Compatible Solvent HALLIBURTON ENERGY SERVICES, INC. (US) 2020-06-04 US claimed
US-10604850-B2 Corrosion inhibition of HCL treatment fluids with environmentally compatible solvent HALLIBURTON ENERGY SERVICES, INC. (US) 2020-03-31 US claimed
US-20180127882-A1 Corrosion Inhibition of HCL Treatment Fluids with Environmentally Compatible Solvent HALLIBURTON ENERGY SERVICES, INC. (US) 2018-05-10 US claimed
WO-2016190865-A1 CORROSION INHIBITION OF HCL TREATMENT FLUIDS WITH ENVIRONMENTALLY COMPATIBLE SOLVENT HALLIBURTON ENERGY SERVICES, INC. (US) 2016-12-01 WO claimed
EP-2646600-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING REACTION PRODUCTS OF ALDEHYDES AND AMIDES AND RELATED METHODS Halliburton Energy Services, Inc. (US) 2013-10-09 EP claimed
US-8361937-B2 Corrosion inhibitor compositions comprising reaction products of aldehydes and amides and related methods HALLIBURTON ENERGY SERVICES, INC. (US) 2013-01-29 US claimed
WO-2012072986-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING REACTION PRODUCTS OF ALDEHYDES AND AMIDES AND RELATED METHODS HALLIBURTON ENERGY SERVICES, INC. (US) 2012-06-07 WO claimed
US-20120142563-A1 Corrosion Inhibitor Compositions Comprising Reaction Products of Aldehydes and Amides and Related Methods HALLIBURTON ENERGY SERVICES, INC. (US) 2012-06-07 US claimed
US-11066749-B2 Corrosion inhibition of HCL treatment fluids with environmentally compatible solvent HALLIBURTON ENERGY SERVICES, INC. (US) 2021-07-20 US disclosed
US-20200173034-A1 Corrosion Inhibition of HCL Treatment Fluids with Environmentally Compatible Solvent HALLIBURTON ENERGY SERVICES, INC. (US) 2020-06-04 US disclosed
US-10604850-B2 Corrosion inhibition of HCL treatment fluids with environmentally compatible solvent HALLIBURTON ENERGY SERVICES, INC. (US) 2020-03-31 US disclosed
US-20180127882-A1 Corrosion Inhibition of HCL Treatment Fluids with Environmentally Compatible Solvent HALLIBURTON ENERGY SERVICES, INC. (US) 2018-05-10 US disclosed
WO-2016190865-A1 CORROSION INHIBITION OF HCL TREATMENT FLUIDS WITH ENVIRONMENTALLY COMPATIBLE SOLVENT HALLIBURTON ENERGY SERVICES, INC. (US) 2016-12-01 WO disclosed
EP-2646600-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING REACTION PRODUCTS OF ALDEHYDES AND AMIDES AND RELATED METHODS Halliburton Energy Services, Inc. (US) 2013-10-09 EP disclosed
US-8361937-B2 Corrosion inhibitor compositions comprising reaction products of aldehydes and amides and related methods HALLIBURTON ENERGY SERVICES, INC. (US) 2013-01-29 US disclosed
WO-2012072986-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING REACTION PRODUCTS OF ALDEHYDES AND AMIDES AND RELATED METHODS HALLIBURTON ENERGY SERVICES, INC. (US) 2012-06-07 WO disclosed
US-20120142563-A1 Corrosion Inhibitor Compositions Comprising Reaction Products of Aldehydes and Amides and Related Methods HALLIBURTON ENERGY SERVICES, INC. (US) 2012-06-07 US disclosed