SCHEMBL9619367

SCHEMBL9619367

OC#CC(O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
CACNA2D1 P54289 1/20 0.48
CACNB2 Q08289 1/20 0.48
CACNA1C Q13936 1/20 0.48
ALDH1A1 P00352 3/20 0.47
MAPK1 P28482 2/20 0.47
HTT P42858 1/20 0.46
LMNA P02545 5/20 0.41
KDM4E B2RXH2 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2C P18825 1/20 0.38
HIF1A Q16665 1/20 0.38
CYP2D6 P10635 1/20 0.37
SRC P12931 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 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
SCHEMBL9547891 0.87 TSHR (0.64) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL9856659 0.82 CACNA2D1 (0.66) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL16986763 0.79 TSHR (0.61) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL9119346 0.78 TSHR (0.54) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL9389599 0.78 TSHR (0.60) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL23996119 0.78 TSHR (0.54) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL15283729 0.78 TSHR (0.60) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL9996023 0.78 TSHR (0.60) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL96275 0.78 TSHR (0.54) TSHRCACNA2D1CACNB2CACNA1CALDH1A1
SCHEMBL2799171 0.78 TSHR (0.48) TSHRCACNA2D1CACNB2CACNA1CALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117529377-A Organic binder, composition for producing inorganic material molded body, green body, degreased body, inorganic material molded body, and method for producing inorganic material molded body 株式会社吴羽 2024-02-06 CN disclosed
EP-0356412-B1 USE OF 2-AMINO-4-MORPHOLINO-6-PROPYL-1,3,5-TRIAZINES IN THE PREPARATION OF A MEDICAMENT FOR THE TREATMENT OF COGNITIVE AND MENTAL DISORDERS U C B, S.A. (BE) 1992-05-13 EP disclosed
EP-0356413-B1 2-AMINO-4-MORPHOLINO-6-PROPYL-1,3,5-TRIAZINES U C B, S.A. (BE) 1992-01-29 EP disclosed
EP-0356413-A1 2-Amino-4-morpholino-6-propyl-1,3,5-triazines U C B, S.A. (BE) 1990-02-28 EP disclosed