SCHEMBL11269363

SCHEMBL11269363

O=C(Cn1cccnc1=O)c1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.46
▸ ERCC5 P28715 1/20 0.44
▸ FEN1 P39748 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ CXCR3 P49682 1/20 0.43
▸ TSHR P16473 2/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ THRB P10828 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ HSD11B1 P28845 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NLRP3 Q96P20 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ PARP1 P09874 1/20 0.41

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
SCHEMBL5721986 0.74 ALPG (0.47) IDO1ERCC5FEN1USP2CXCR3
SCHEMBL11042469 0.74 TRPA1 (0.39) TSHRPOLBSMN1; SMN2ALDH1A1
SCHEMBL29669994 0.73 ALPG (0.63) KMT2A
SCHEMBL28549268 0.73 ALPG (0.63) KMT2A
SCHEMBL5721975 0.72 CA12 (0.51) ERCC5FEN1CXCR3ALDH1A1
SCHEMBL5722000 0.72 ALPG (0.45) IDO1ERCC5FEN1CXCR3TSHR
SCHEMBL5721917 0.71 ALPG (0.46) IDO1ERCC5FEN1CXCR3KMT2A
SCHEMBL1155881 0.71 ALDH1A1 (0.42) KMT2APOLBALDH1A1
SCHEMBL11964124 0.70 LMNA (0.38) TSHRPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL401800 0.69 GSK3B (0.57) IDO1ERCC5FEN1USP2CXCR3

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
EP-0044704-A1 Substituted pyrimidin-2-ones, the salts thereof, processes for their preparation, and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1982-01-27 — — EP disclosed
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