SCHEMBL9724038

SCHEMBL9724038

CCOC(=O)C1CSCN1C(=O)Cc1c(C)cccc1C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACE P12821 1/20 0.39
HSD17B10 Q99714 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38
PREP P48147 4/20 0.38
NR1D1 P20393 3/20 0.38
GAA P10253 1/20 0.37
ALDH1A1 P00352 3/20 0.37
CACNA1A O00555 1/20 0.36
CACNA2D1 P54289 1/20 0.36
CACNB1 Q02641 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35

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
SCHEMBL9724034 0.88 KMT2A (0.50) KMT2AMEN1SMN1; SMN2ACEHSD17B10
SCHEMBL9724030 0.88 POLB (0.36) KMT2AMEN1SMN1; SMN2ACEHSD17B10
SCHEMBL9724045 0.83 KMT2A (0.61) KMT2AMEN1SMN1; SMN2GAAALDH1A1
SCHEMBL9383401 0.81 ALDH1A1 (0.35) KMT2AMEN1SMN1; SMN2ACEHSD17B10
SCHEMBL9724032 0.81 KMT2A (0.38) KMT2AMEN1SMN1; SMN2ACEPREP
SCHEMBL9724044 0.80 P2RX7 (0.36) KMT2ASMN1; SMN2ACEHSD17B10NPSR1
SCHEMBL8876496 0.78 KMT2A (0.40) KMT2AMEN1SMN1; SMN2HSD17B10NR1D1
SCHEMBL8876386 0.78 CTSS (0.40) KMT2AMEN1SMN1; SMN2HSD17B10NR1D1
SCHEMBL8875827 0.77 KMT2A (0.41) KMT2AMEN1SMN1; SMN2HSD17B10NR1D1
SCHEMBL8875537 0.77 KMT2A (0.39) KMT2AMEN1SMN1; SMN2HSD17B10NR1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5116836-A Herbicides, insecticides, miticides BAYER AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed