Water

Water

SCHEMBL15375422

CCC[N+]1(C)CCCCC1.[OH-]

nearest known ligand 0.50

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 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
BBOX1 O75936 2/20 0.41
TP53 P04637 1/20 0.38
LMNA P02545 4/20 0.37
KMT2A Q03164 2/20 0.37
APOBEC3A P31941 2/20 0.37
APOBEC3G Q9HC16 2/20 0.37
CHRNB2 P17787 2/20 0.36
CHRNA4 P43681 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
CHRNA7 P36544 4/20 0.33
TSHR P16473 2/20 0.33
CTDSP1 Q9GZU7 2/20 0.33
CYP3A4 P08684 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 SCHEMBL15364815 0.97 KDM4E (0.46) KDM4EBBOX1TP53LMNAKMT2A
SCHEMBL222638 0.97 KDM4E (0.52) KDM4EBBOX1TP53LMNAKMT2A
Fluoride Ion SCHEMBL1977758 0.94 KDM4E (0.50) KDM4EBBOX1TP53LMNAKMT2A
Iodide SCHEMBL16107572 0.94 KDM4E (0.56) KDM4EBBOX1TP53LMNAKMT2A
Hydrochloric Acid SCHEMBL16931602 0.94 KDM4E (0.50) KDM4EBBOX1TP53LMNAKMT2A
Bromide SCHEMBL1976599 0.94 KDM4E (0.50) KDM4EBBOX1TP53LMNAKMT2A
SCHEMBL302222 0.94
Bromide SCHEMBL2191358 0.92 KDM4E (0.46) KDM4EBBOX1TP53LMNAKMT2A
Hydrochloric Acid SCHEMBL715359 0.92 BBOX1 (0.46) KDM4EBBOX1TP53LMNAKMT2A
Ammonia Solution, Strong SCHEMBL17998010 0.92 KDM4E (0.46) KDM4EBBOX1TP53LMNAKMT2A

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 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10228621-B2 Underlayer film-forming composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-03-12 US claimed
EP-2813890-B1 Photoresist underlayer film-forming composition and pattern forming processes SHINETSU CHEMICAL CO (JP) 2018-05-30 EP claimed
EP-2813889-B1 Photoresist underlayer film-forming composition and pattern forming process SHINETSU CHEMICAL CO (JP) 2018-02-07 EP claimed
EP-2813891-B1 Photoresist underlayer film-forming composition and pattern forming process SHINETSU CHEMICAL CO (JP) 2018-01-17 EP claimed
US-9136121-B2 Underlayer film-forming composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-09-15 US claimed
US-9136122-B2 Underlayer film-forming composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-09-15 US claimed
US-9052602-B2 Developer for photosensitive resist material and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-06-09 US claimed
US-20140370441-A1 DEVELOPER FOR PHOTOSENSITIVE RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-18 US claimed
EP-2813891-A2 Photoresist underlayer film-forming composition and pattern forming process Shin-Etsu Chemical Co., Ltd. (JP) 2014-12-17 EP claimed
EP-2813889-A2 Photoresist underlayer film-forming composition and pattern forming process Shin-Etsu Chemical Co., Ltd. (JP) 2014-12-17 EP claimed
EP-2813892-A2 Photoresist underlayer film-forming composition and pattern forming process Shin-Etsu Chemical Co., Ltd. (JP) 2014-12-17 EP claimed
EP-2813890-A2 Photoresist underlayer film-forming composition and pattern forming process Shin-Etsu Chemical Co., Ltd. (JP) 2014-12-17 EP claimed
US-20140363958-A1 UNDERLAYER FILM-FORMING COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-11 US claimed
US-20140363956-A1 UNDERLAYER FILM-FORMING COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-11 US claimed
US-20140363957-A1 UNDERLAYER FILM-FORMING COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-11 US claimed
US-20140363955-A1 UNDERLAYER FILM-FORMING COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-11 US claimed
US-20260118764-A1 COMPOSITION FOR FORMING SILICON-CONTAINING RESIST UNDERLAYER FILM AND SILICON-CONTAINING RESIST UNDERLAYER FILM NISSAN CHEMICAL CORPORATION (JP) 2026-04-30 US disclosed
US-12585188-B2 Composition for forming resist underlying film NISSAN CHEMICAL CORPORATION (JP) 2026-03-24 US disclosed
US-20130323155-A1 PROCESS FOR PRODUCING FLUORINE-CONTAINING SULFONYLIMIDE SALT NIPPON SODA CO., LTD. (JP) 2013-12-05 US disclosed
EP-2662332-A1 MANUFACTURING METHOD FOR FLUORINE-CONTAINING SULFONYL IMIDE SALT Nippon Soda Co., Ltd. (JP) 2013-11-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260118764-A1 COMPOSITION FOR FORMING SILICON-CONTAINING RESIST UNDERLAYER FILM AND SILICON-CONTAINING RESIST UNDERLAYER FILM SRSF1, MACF1, SRPK1 KDM4E 63/4885BBOX1 4529/4885TP53 2101/4885
US-12585188-B2 Composition for forming resist underlying film SRR, SMC1A, ASH2L KDM4E 550/4885BBOX1 2111/4885TP53 4706/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.