Water

Water

SCHEMBL3305069

CC[N+](C)(CC)CCCCO.[OH-]

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.41
DNM1 Q05193 3/20 0.39
LMNA P02545 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
Water SCHEMBL3302508 0.95 BBOX1 (0.41) BBOX1SMN1; SMN2DNM1LMNAKMT2A
SCHEMBL10256276 0.95 BBOX1 (0.46) BBOX1SMN1; SMN2DNM1LMNAKMT2A
Iodide SCHEMBL28851599 0.92 BBOX1 (0.45) BBOX1SMN1; SMN2DNM1LMNAKMT2A
Water SCHEMBL3301963 0.92 BBOX1 (0.48) BBOX1SMN1; SMN2DNM1LMNAKMT2A
SCHEMBL8470265 0.89 BBOX1 (0.50) BBOX1SMN1; SMN2DNM1LMNAKMT2A
Water SCHEMBL3307852 0.86 BBOX1 (0.43) BBOX1SMN1; SMN2DNM1LMNAKMT2A
Water SCHEMBL3306871 0.86 SMN1; SMN2 (0.40) SMN1; SMN2DNM1LMNAKMT2AALDH1A1
SCHEMBL21405556 0.83 SMN1; SMN2 (0.42) SMN1; SMN2DNM1LMNAKMT2AALDH1A1
Water SCHEMBL17628683 0.83 BBOX1 (0.48) BBOX1SMN1; SMN2DNM1LMNAKMT2A
Acetic Acid SCHEMBL28851660 0.83 BBOX1 (0.57) BBOX1SMN1; SMN2DNM1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10304694-B2 Semiconductor treatment composition and treatment method JSR CORPORATION (JP) 2019-05-28 US disclosed
US-20190122896-A1 SEMICONDUCTOR TREATMENT COMPOSITION JSR CORPORATION (JP) 2019-04-25 US disclosed
US-20180226267-A1 SEMICONDUCTOR TREATMENT COMPOSITION AND TREATMENT METHOD JSR CORPORATION (JP) 2018-08-09 US disclosed
CN-105986308-A Electrolyte composition for removing flash and method for removing flash 化研科技株式会社 2016-10-05 CN disclosed
US-8349207-B2 Aqueous dispersion for chemical mechanical polishing and chemical mechanical polishing method for semiconductor device JSR CORPORATION (JP) 2013-01-08 US disclosed
US-20100099260-A1 AQUEOUS DISPERSION FOR CHEMICAL MECHANICAL POLISHNG AND CHEMICAL MECHANICAL POLISHING METHOD FOR SEMICONDUCTOR DEVICE JSR CORPORATION (JP) 2010-04-22 US disclosed
EP-2131389-A1 AQUEOUS DISPERSION FOR CHEMICAL MECHANICAL POLISHING AND CHEMICAL MECHANICAL POLISHING METHOD FOR SEMICONDUCTOR DEVICE JSR Corporation (JP) 2009-12-09 EP disclosed
US-20040077512-A1 Cleaning agent for a semi-conductor substrate WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2004-04-22 US disclosed
US-6716803-B2 HAVING COPPER WIRINGS ON ITS SURFACE, COMPRISING A NONIONIC SURFACTANT, ESPECIALLY A POLYOXYALKYLENE COMPOUNDS CONTAINING AN ACETYLENIC GROUP. WAKO PURE CHEMCIAL INDUSTRIES, LTD. (JP) 2004-04-06 US disclosed
US-6534458-B1 This invention relates to a cleaning agent for a semi-conductor substrate, particularly, one having copper wirings on its surface, comprising a nonionic surfactant and a method for cleaning the same. control a speed of etching on WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2003-03-18 US disclosed
US-20020016272-A1 Cleaning agent for a semi-conductor substrate WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2002-02-07 US disclosed
US-6310019-B1 COMPRISING NONIONIC SURFACTANT; FOR CLEANING SURFACE HAVING COPPER WIRINGS; CORROSION RESISTANCE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2001-10-30 US disclosed