SCHEMBL10508380

SCHEMBL10508380

[CH2]CCCCCNC(=O)S

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
EPHX1 P07099 5/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A2 O94788 1/20 0.38
ALDH2 P05091 1/20 0.38
ALDH1A3 P47895 1/20 0.38
PRMT1 Q99873 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
PAOX Q6QHF9 2/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
POLB P06746 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34

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
SCHEMBL12807564 0.87 KDM4E (0.52) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL9615037 0.87 KDM4E (0.52) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL716827 0.78 KDM4E (0.44) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL2865720 0.78 KDM4E (0.44) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL28945606 0.78 KDM4E (0.44) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL2863141 0.78 KDM4E (0.44) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL6358914 0.78 KDM4E (0.44) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL28794531 0.78 KDM4E (0.44) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL9532818 0.76 EPHX1 (0.67) EPHX1ZDHHC20ZDHHC2CASP2
SCHEMBL5932682 0.76 EPHX1 (0.67) EPHX1ZDHHC20ZDHHC2CASP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1249704-A None JP disclosed
JP-58079908-A None JP disclosed
JP-H01249704-A HERBICIDAL COMPOSITION AND METHOD FOR CONTROLLING WEED MITSUI TOATSU CHEM INC 1989-10-05 JP disclosed
EP-0302378-A2 Sulphonylaminoguanidino azines BAYER AG (DE) 1989-02-08 EP disclosed
EP-0054431-B1 OPTICAL ISOMER OF A TRIAZOLYLPENTENOL, AND ITS PRODUCTION AND USE AS FUNGICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-03-04 EP disclosed
EP-0070389-B1 2-(2-FLUORO-4-HALO-5-SUBSTITUTED PHENYL) HYDANTOINS, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-10-02 EP disclosed
JP-S5879908-A MIXED HERBICIDE MITSUI TOATSU CHEM INC 1983-05-13 JP disclosed