SCHEMBL474901

SCHEMBL474901

NC(=O)C(CCO)CCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.42
CA1 P00915 1/20 0.42
THRB P10828 1/20 0.32
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 2/20 0.31
GABRB2 P47870 2/20 0.31
GABRA4 P48169 2/20 0.31
GABRE P78334 2/20 0.31
GABRA6 Q16445 2/20 0.31
GABRG1 Q8N1C3 2/20 0.31
GABRG3 Q99928 2/20 0.31
GABRQ Q9UN88 2/20 0.31
TSHR P16473 2/20 0.30

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
SCHEMBL8306591 0.89 CA1 (0.37) CA2CA1TSHR
SCHEMBL1685420 0.88
SCHEMBL6369370 0.87 ALOX15 (0.43) CA2CA1GABRPGABRDGABRA1
SCHEMBL10431485 0.87 CA1 (0.35) CA2CA1
SCHEMBL10776270 0.87 CA2 (0.50) CA2CA1TSHRNFKB1CYP3A4
SCHEMBL1231804 0.85 CA1 (0.43) CA2CA1BLMPMP22
SCHEMBL1230306 0.84 CA1 (0.37) CA2CA1BLMPMP22
SCHEMBL4255669 0.84
SCHEMBL28059222 0.84
SCHEMBL2583977 0.83 CA1 (0.42) CA2CA1CYP1A2CYP3A4BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109563043-A SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 葛兰素史密斯克莱知识产权发展有限公司 2019-04-02 CN claimed
US-4543371-A Polymeric compositions and hydrogels formed therefrom SYNTEX (U.S.A.) INC. (US) 1985-09-24 US claimed
US-4379864-A Polymeric compositions and hydrogels formed therefrom SYNTEX (U.S.A.) INC. (US) 1983-04-12 US claimed
US-4267295-A Polymeric compositions and hydrogels formed therefrom SYNTEX (U.S.A.) INC. (US) 1981-05-12 US claimed
EP-4077273-A1 ALDIMINES AND USES THEREOF Bostik SA (FR) 2022-10-26 EP disclosed
CN-109563043-A SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 葛兰素史密斯克莱知识产权发展有限公司 2019-04-02 CN disclosed
CN-106794682-B Coated-body 大日本涂料株式会社 2018-09-18 CN disclosed
CN-106794682-A Coated-body 大日本涂料株式会社 2017-05-31 CN disclosed
CN-106164068-A Isoindolinone compounds as the GPR119 regulator for the treatment of diabetes, obesity, dyslipidemia and associated conditions 赛诺菲 2016-11-23 CN disclosed
CN-106118196-A Powder coating composition and manufacture method thereof 大日本涂料株式会社 2016-11-16 CN disclosed
EP-3041895-A1 ICI THICKENER COMPOSITION AND USES Elementis Specialties, Inc. (US) 2016-07-13 EP disclosed
EP-2112206-B1 Polymer Composition ROHM & HAAS (US) 2016-06-29 EP disclosed
US-4338419-A REDUCING IRRITATION FROW WEARING CONTACT LENSES SYNTEX (U.S.A.) INC. (US) 1982-07-06 US disclosed
US-4290812-A Process for the production of inks free of foreign salts OLYMPIA WERKE AG (DE) 1981-09-22 US disclosed
EP-0032905-A4 CONTACT LENSES WITH POLYMER BOUND ASEPTICIZING AGENTS. FOLEY WILLIAM M JUN 1981-08-27 EP disclosed
EP-0032905-A1 CONTACT LENSES WITH POLYMER BOUND ASEPTICIZING AGENTS FOLEY, Jr., William M. (US) 1981-08-05 EP disclosed
US-4267295-A Polymeric compositions and hydrogels formed therefrom SYNTEX (U.S.A.) INC. (US) 1981-05-12 US disclosed
WO-1980002840-A1 CONTACT LENSES WITH POLYMER BOUND ASEPTICIZING AGENTS FOLEY W 1980-12-24 WO disclosed
US-4180308-A Contact lens SYNTEX (USA) INC. (US) 1979-12-25 US disclosed
US-4056496-A ACRYLIC CORNEAL SCIENCES, INC. (US) 1977-11-01 US disclosed