SCHEMBL8084375

SCHEMBL8084375

C=C(C)C(=O)OCC(O)CCCO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
ALDH1A1 P00352 4/20 0.39
USP2 O75604 3/20 0.39
CYP3A4 P08684 2/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
THRB P10828 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 1/20 0.33
DUSP3 P51452 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PTPN1 P18031 1/20 0.32

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
SCHEMBL8037794 0.95 TSHR (0.52) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL11232229 0.91 TSHR (0.59) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL328805 0.89 TSHR (0.57) TSHRALDH1A1USP2CYP3A4MAPT
1,4-Butanediol SCHEMBL22607675 0.86 TSHR (0.53) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL8965903 0.86 TSHR (0.53) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL28613462 0.86 TSHR (0.53) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL1132615 0.86 TSHR (0.53) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL2781460 0.84 TSHR (0.61) TSHRALDH1A1USP2CYP3A4MAPT
1,4-Butanediol SCHEMBL1201330 0.84 TSHR (0.52) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL11051294 0.84 TSHR (0.56) TSHRALDH1A1USP2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-111201300-B Ink comprising encapsulated nanoparticles 奈科斯多特股份公司 2024-03-15 CN disclosed
WO-2023057419-A1 CONDUCTIVE INKS AGFA-GEVAERT NV (BE) 2023-04-13 WO disclosed
EP-4163343-A1 CONDUCTIVE INKS AGFA-GEVAERT NV (BE) 2023-04-12 EP disclosed
EP-3630920-B1 INK COMPRISING ENCAPSULATED NANOPARTICLES NEXDOT (FR) 2022-12-07 EP disclosed
CN-109642101-B Metal nanoparticle dispersions 爱克发-格法特公司 2022-01-25 CN disclosed
EP-0889917-B1 NOVEL POLYMERIC SULFIDE MINERAL DEPRESSANTS CYTEC TECH CORP (US) 2000-11-02 EP disclosed
US-5959054-A TERPOLYMER CONTAINING ACRYLAMIDE, ALLYL THIOUREA AND HYDROXYETHYL ACRYLATE CYTEC TECHNOLOGY CORP. (US) 1999-09-28 US disclosed
EP-0889917-A1 NOVEL POLYMERIC SULFIDE MINERAL DEPRESSANTS Cytec Technology Corp. (US) 1999-01-13 EP disclosed
US-5756622-A TERPOLYMER OF (METH)ACRYLAMIDE, ALLYL THIOUREA AND HYDROXYALKYL (METH)ACRYLATE CYTEC TECHNOLOGY CORP. (US) 1998-05-26 US disclosed
WO-1997035897-A1 NOVEL POLYMERIC SULFIDE MINERAL DEPRESSANTS CYTEC TECHNOLOGY CORP. (US) 1997-10-02 WO disclosed
US-4543371-A Polymeric compositions and hydrogels formed therefrom SYNTEX (U.S.A.) INC. (US) 1985-09-24 US disclosed
US-4379864-A Polymeric compositions and hydrogels formed therefrom SYNTEX (U.S.A.) INC. (US) 1983-04-12 US disclosed
US-4267295-A Polymeric compositions and hydrogels formed therefrom SYNTEX (U.S.A.) INC. (US) 1981-05-12 US disclosed