SCHEMBL112236

SCHEMBL112236

CC1(O)CCC(O)CC1.OC1CCC(O)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.40
TSHR P16473 2/20 0.35
SHBG P04278 4/20 0.33
LMNA P02545 2/20 0.33
GPBAR1 Q8TDU6 2/20 0.33
SERPINA6 P08185 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NR1I3 Q14994 1/20 0.31

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
SCHEMBL180095 0.97
SCHEMBL16750985 0.97
SCHEMBL16730136 0.97
Cyclohexane SCHEMBL7502003 0.89 TSHR (0.38) ESR2TSHRSHBGLMNAGPBAR1
SCHEMBL9815694 0.87 TSHR (0.43) ESR2TSHRSHBGLMNAGPBAR1
SCHEMBL20902010 0.85 TSHR (0.41) ESR2TSHRSHBGLMNAGPBAR1
SCHEMBL22484527 0.80
SCHEMBL308699 0.80
SCHEMBL21827980 0.80
SCHEMBL21827458 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822211-B2 Polyurethanes, articles and coatings prepared therefrom and methods of making the same PPG INDUSTRIES OHIO, INC. (US) 2017-11-21 US claimed
US-20140364026-A1 Polyurethanes, Articles and Coatings Prepared Therefrom and Methods of Making the Same PPG INDUSTRIES OHIO, INC. 2014-12-11 US claimed
US-20240117215-A1 POLYFUNCTIONAL HYDRAZIDE CROSSLINKER PPG INDUSTRIES OHIO, INC. (US) 2024-04-11 US disclosed
US-20230365737-A1 ISO(THIO)CYANATE COMPOUND, POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, MOLDED BODY, OPTICAL MATERIAL, PLASTIC LENS, PLASTIC POLARIZING LENS, METHOD FOR PRODUCING ISO(THIO)CYANATE COMPOUND, METHOD FOR PRODUCING POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, METHOD FOR PRODUCING OPTICAL MATERIAL, AND METHOD FOR PRODUCING PLASTIC POLARIZING LENS MITSUI CHEMICALS, INC. (JP) 2023-11-16 US disclosed
US-11807707-B2 Polyurethane prepolymers incorporating nonlinear short chain diols and/or soft diisocyanates compositions, and uses thereof PRC-DESOTO INTERNATIONAL, INC. (US) 2023-11-07 US disclosed
EP-4259678-A1 POLYFUNCTIONAL HYDRAZIDE CROSSLINKER PPG Industries Ohio Inc. (US) 2023-10-18 EP disclosed
US-20230272188-A1 ADDITIVE COMPOSITION, RESIN COMPOSITION CONTAINING SAME, AND MOLDED ARTICLE OF SAID RESIN COMPOSITION ADEKA CORPORATION (JP) 2023-08-31 US disclosed
CN-116583547-A Multifunctional hydrazide crosslinking agents PPG工业俄亥俄公司 2023-08-11 CN disclosed
WO-2023150473-A1 POLYCARBONATE-BASED POLYURETHANE TOPCOATS PRC-DESOTO INTERNATIONAL, INC. (US) 2023-08-10 WO disclosed
US-20230220219-A1 COMPOSITIONS CONTAINING THERMALLY CONDUCTIVE FILLERS PPG INDUSTRIES OHIO, INC. (US) 2023-07-13 US disclosed
EP-4183827-A1 ADDITIVE COMPOSITION, RESIN COMPOSITION CONTAINING SAME, AND MOLDED ARTICLE OF SAID RESIN COMPOSITION ADEKA CORPORATION (JP) 2023-05-24 EP disclosed
US-5973093-A PHOTOCHROMIC ARTICLE PPG INDUSTRIES OHIO, INC. (US) 1999-10-26 US disclosed
US-5965680-A Optical resin composition from polyol((meth)acryloyl carbonate) monomer PPG INDUSTRIES OHIO, INC. (US) 1999-10-12 US disclosed
US-5942158-A PHOTOCHROMIC ARTICLE PPG INDUSTRIES OHIO, INC. (US) 1999-08-24 US disclosed
US-5932681-A PHOTOCHROMIC ARTICLE PPG INDUSTRIES OHIO, INC. (US) 1999-08-03 US disclosed
WO-1999036450-A1 OPTICAL RESIN COMPOSITION PPG INDUSTRIES OHIO, INC. (US) 1999-07-22 WO disclosed
US-5917006-A POLYTHIO ETHER POLYMER, VINYL MONOMER AND METHACRYLIC ANHYDRIDE OR OTHER OLEFIN ANHYDRIDE PPG INDUSTRIES OHIO, INC. (US) 1999-06-29 US disclosed
US-5811503-A FOR PHOTOCHROMIC ARTICLES, LENSES PPG INDUSTRIES, INC. (US) 1998-09-22 US disclosed
WO-1998037115-A1 PHOTOCHROMIC POLYURETHANE COATING AND ARTICLES HAVING SUCH A COATING PPG INDUSTRIES OHIO, INC. (US) 1998-08-27 WO disclosed
US-5739243-A ACRYLATED RESINS; PHOTOCHROMIC ARTICLES; LENSES PPG INDUSTRIES, INC. (US) 1998-04-14 US disclosed