SCHEMBL5209342

SCHEMBL5209342

Cc1nc(O)cc(=O)n1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
APLNR P35414 7/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
CSNK1E P49674 1/20 0.33
CLK1 P49759 1/20 0.33
CLK2 P49760 1/20 0.33
CLK3 P49761 1/20 0.33
GSK3B P49841 1/20 0.33
CDK5 Q00535 1/20 0.33
DYRK1A Q13627 1/20 0.33
CDK5R1 Q15078 1/20 0.33
DYRK2 Q92630 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
DYRK4 Q9NR20 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
SCHEMBL5203831 0.77 TSHR (0.46) L3MBTL1APLNRTDP1SMN1; SMN2LMNA
SCHEMBL11508032 0.69 L3MBTL1 (0.45) L3MBTL1APLNRTDP1SMN1; SMN2LMNA
SCHEMBL24759505 0.68 POLB (0.50) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL11293066 0.68 IDH1 (0.34) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL11506676 0.65 ALDH1A1 (0.41) L3MBTL1APLNRTDP1ALDH1A1SMN1; SMN2
SCHEMBL30067927 0.64 L3MBTL1 (0.44) L3MBTL1APLNRTDP1SMN1; SMN2LMNA
SCHEMBL5203856 0.64 ALDH1A1 (0.33) L3MBTL1ALDH1A1SMN1; SMN2LMNAKMT2A
SCHEMBL5207275 0.64 POLB (0.35) L3MBTL1ALDH1A1KMT2AMEN1NR1I2
SCHEMBL24644594 0.64 ALDH1A1 (0.41) TDP1ALDH1A1SMN1; SMN2LMNACASR
SCHEMBL11507037 0.63 ALDH1A1 (0.47) L3MBTL1APLNRTDP1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1802590-A1 SUBSTITUTED N-ALKYLPYRIMIDINONES Pharmacia & Upjohn Company LLC (US) 2007-07-04 EP disclosed
WO-2006040666-A1 SUBSTITUTED N-ALKYLPYRIMIDINONES PHARMACIA & UPJOHN COMPANY LLC (US) 2006-04-20 WO disclosed
US-4152426-A NEMATOCIDES, MITICIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-05-01 US disclosed