SCHEMBL20874403

SCHEMBL20874403

CCOC(=O)C(C#N)=CNc1ccc2nc(C)sc2c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.55
KDM4E B2RXH2 6/20 0.52
ALDH1A1 P00352 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
MAPT P10636 2/20 0.52
MEN1 O00255 1/20 0.52
TSHR P16473 1/20 0.52
KMT2A Q03164 1/20 0.52
LDHA P00338 2/20 0.50
GAA P10253 3/20 0.47
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
RXFP1 Q9HBX9 2/20 0.47
LMNA P02545 1/20 0.47
NPSR1 Q6W5P4 2/20 0.47
POLB P06746 1/20 0.47
HPGD P15428 1/20 0.47
MIF P14174 1/20 0.46

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
SCHEMBL20874402 1.00 DHODH (0.55) DHODHKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL3836341 0.77 DHODH (0.61) DHODHKDM4ESMN1; SMN2MAPTMEN1
SCHEMBL2491910 0.77 DHODH (0.56) DHODHKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL2491908 0.77 DHODH (0.56) DHODHKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL14079746 0.75 LDHA (0.68) KDM4EALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL11806502 0.75 ALDH1A1 (0.66) DHODHKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL11806491 0.75 ALDH1A1 (0.66) DHODHKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL4724694 0.75 ALDH1A1 (0.67) DHODHKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL14314065 0.75 ALDH1A1 (0.67) DHODHKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL4724693 0.75 ALDH1A1 (0.67) DHODHKDM4EALDH1A1SMN1; SMN2MAPT

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-109071976-B Radiation curable ink formulations 富林特集团瑞典有限公司 2022-06-03 CN disclosed
EP-3445826-B1 RADIATION CURABLE INK FORMULATION FLINT GROUP GERMANY GMBH (DE) 2021-07-14 EP disclosed
US-20190106583-A1 RADIATION CURABLE INK FORMULATION FLINT GROUP SWEDEN AB (SE) 2019-04-11 US disclosed
CN-109071976-A Radiation curable ink preparation 富林特集团德国有限公司 2018-12-21 CN disclosed