SCHEMBL17157136

SCHEMBL17157136

O=C(CS)Nc1nnco1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 1/20 0.40
▸ CSNK2B P67870 1/20 0.40
▸ CSNK2A1 P68400 1/20 0.40
▸ CSNK2A3 Q8NEV1 1/20 0.40
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ALOX5 P09917 1/20 0.33
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL19755675 0.70 KDM4E (0.43) CSNK2A2CSNK2BCSNK2A1CSNK2A3MAPT
SCHEMBL9312752 0.62 CHRM2 (0.46) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL22750752 0.62 — —
SCHEMBL1509976 0.62 MEN1 (0.64) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL1007070 0.61 — —
SCHEMBL25234778 0.60 MEN1 (0.36) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL14746911 0.60 NOTUM (0.31) CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL8286810 0.59 BCHE (0.61) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL708021 0.59 TSHR (0.40) MAPTMEN1POLBKMT2AL3MBTL1
SCHEMBL2639258 0.58 ALDH1A1 (0.70) MAPTMEN1POLBKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9383360-B2 Compositions and methods relating to lyme disease THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2016-07-05 — — US disclosed
US-20150293096-A1 COMPOSITIONS AND METHODS RELATING TO LYME DISEASE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2015-10-15 — — US disclosed
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