SCHEMBL19645927

SCHEMBL19645927

O=C(NCc1c[nH]c(=S)[nH]c1=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM3B Q7LBC6 1/20 0.41
MTNR1A P48039 2/20 0.38
MEN1 O00255 2/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CDK5 Q00535 1/20 0.33
TAOK1 Q7L7X3 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
CA3 P07451 2/20 0.30
CA5A P35218 2/20 0.30
CA5B Q9Y2D0 2/20 0.30
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA7 P43166 1/20 0.30

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
SCHEMBL21585270 0.85 MTNR1A (0.39) MTNR1AALDH1A1SMN1; SMN2
SCHEMBL11949361 0.73 MEN1 (0.33) KMT2AMEN1USP2ALDH1A1POLB
SCHEMBL104627 0.73 KMT2A (0.48) KMT2ATDP1KDM3BMEN1ALDH1A1
SCHEMBL21345745 0.70 KMT2A (0.54) KMT2ATDP1KDM3BMEN1ALDH1A1
SCHEMBL1227831 0.69 KMT2A (0.62) KMT2ATDP1KDM3BMEN1ALDH1A1
SCHEMBL101704 0.69 KMT2A (0.50) KMT2ATDP1KDM3BMEN1ALDH1A1
SCHEMBL18640323 0.68 KMT2A (0.60) KMT2ATDP1KDM3BMEN1
SCHEMBL153162 0.68 KMT2A (0.73) KMT2ATDP1KDM3BMEN1ALDH1A1
SCHEMBL3537530 0.67 KMT2A (0.51) KMT2ATDP1KDM3BMEN1ALDH1A1
SCHEMBL29638100 0.67 KMT2A (0.42) KMT2ATDP1KDM3B

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-9827332-B2 Modified polynucleotides for the production of proteins MODERNATX, INC. (US) 2017-11-28 US disclosed