SCHEMBL117328

SCHEMBL117328

CC(C)COC(=O)c1cc(N)cc(N)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
TSHR P16473 2/20 0.50
GPR35 Q9HC97 1/20 0.41
KDM4E B2RXH2 4/20 0.40
CACNA1F O60840 2/20 0.40
CACNA1D Q01668 2/20 0.40
CACNA1S Q13698 2/20 0.40
CACNA1C Q13936 2/20 0.40
TDP1 Q9NUW8 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 2/20 0.38
HPGD P15428 2/20 0.38
NPSR1 Q6W5P4 2/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37

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
SCHEMBL559800 0.80 GPR35 (0.53) ALDH1A1TSHRGPR35KDM4ECACNA1F
SCHEMBL28002015 0.79 ALDH1A1 (0.47) ALDH1A1TSHRGPR35KDM4ECACNA1F
Ammonia Solution, Strong SCHEMBL28235464 0.78 GPR35 (0.52) ALDH1A1TSHRGPR35KDM4ECACNA1F
SCHEMBL10426056 0.78 ALDH1A1 (0.57) ALDH1A1TSHRKDM4ETDP1GAA
SCHEMBL11061460 0.77 ALDH1A1 (0.51) ALDH1A1TSHRGPR35KDM4ECACNA1F
SCHEMBL4627854 0.75 ALDH1A1 (0.61) ALDH1A1TSHRGPR35KDM4ECACNA1F
SCHEMBL827863 0.74 TSHR (0.70) ALDH1A1TSHRGPR35KDM4ECACNA1F
SCHEMBL3864388 0.74 ALDH1A1 (0.50) ALDH1A1TSHRGPR35KDM4EGAA
SCHEMBL9639553 0.73 ALDH1A1 (0.50) ALDH1A1TSHRGPR35KDM4ECACNA1F
SCHEMBL28309007 0.73 CYP3A4 (0.40) KDM4ETDP1GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117820843-A Polyurethane elastomer and preparation method thereof 重庆市智翔铺道技术工程有限公司 2024-04-05 CN claimed
CN-115368725-B Thermoplastic polyurethane elastomer composite material with high dielectric constant and low dielectric loss and preparation method thereof 万华化学集团股份有限公司 2023-08-11 CN claimed
CN-109486382-A A kind of lignin-base carbamide paint and preparation method 华南理工大学 2019-03-19 CN claimed
CN-118269278-A Integrally formed steel mesh winding assisting machine belt and preparation method thereof 上海东艾工业皮带有限公司 2024-07-02 CN disclosed
CN-117820843-A Polyurethane elastomer and preparation method thereof 重庆市智翔铺道技术工程有限公司 2024-04-05 CN disclosed
CN-109486382-A A kind of lignin-base carbamide paint and preparation method 华南理工大学 2019-03-19 CN disclosed
EP-2424913-A1 CASTABLE POLYUREA COMPOSITIONS FOR GOLF BALL COVERS Dow Global Technologies LLC (US) 2012-03-07 EP disclosed
WO-2010126931-A1 CASTABLE POLYUREA COMPOSITIONS FOR GOLF BALL COVERS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-11-04 WO disclosed