SCHEMBL5203831

SCHEMBL5203831

CSc1nc(O)cc(=O)n1C(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
APLNR P35414 9/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 3/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP3A4 P08684 1/20 0.37
RECQL P46063 1/20 0.37
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
FPR1 P21462 1/20 0.36
POLB P06746 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
SCHEMBL5209342 0.77 L3MBTL1 (0.41) TSHRAPLNRTDP1LMNAPKM
SCHEMBL5205361 0.77 MAPT (0.54) TSHRAPLNRTDP1LMNAPKM
SCHEMBL5207656 0.76 MEN1 (0.53) TSHRAPLNRTDP1LMNAPKM
SCHEMBL17382812 0.72 MEN1 (0.53) TSHRAPLNRTDP1LMNAMAPT
SCHEMBL13167712 0.70 APLNR (0.68) TSHRAPLNRTDP1MAPTKMT2A
SCHEMBL5207054 0.70 GAA (0.49) TSHRAPLNRTDP1LMNAPKM
SCHEMBL5207259 0.69 POLB (0.47) TSHRAPLNRTDP1LMNAPKM
SCHEMBL17979301 0.68 TSHR (0.58) TSHRAPLNRLMNAMAPTKMT2A
SCHEMBL30879077 0.64 PIM1 (0.39) KMT2AMEN1
SCHEMBL13678619 0.62 TSHR (0.54) TSHRAPLNRLMNAKMT2ARECQL

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
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