SCHEMBL5796880

SCHEMBL5796880

O=c1ccn(CNc2ccccc2)c(=O)[nH]1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DUT P33316 13/20 0.52
DDB1 Q16531 1/20 0.47
CRBN Q96SW2 1/20 0.47
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43

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
SCHEMBL4885281 0.80 CA1 (0.44) DUTALDH1A1LMNA
SCHEMBL1344883 0.75 PKM (0.51) DUTCRBNALDH1A1LMNAPKM
SCHEMBL2800300 0.74 DUT (0.59) DUTDDB1CRBNALDH1A1
SCHEMBL294648 0.72 ALDH1A1 (0.49) DUTCRBNALDH1A1LMNAPKM
SCHEMBL10924758 0.72 PKM (0.55) DUTDDB1CRBNALDH1A1LMNA
SCHEMBL4348697 0.72 L3MBTL1 (0.59) DUTCRBNALDH1A1LMNAPKM
Ethylene SCHEMBL28028835 0.71 DUT (0.56) DUTDDB1CRBNALDH1A1
SCHEMBL19359274 0.71 DUT (0.62) DUTDDB1CRBN
SCHEMBL5907658 0.70 CRBN (0.52) DUTDDB1CRBNPKM
SCHEMBL6102943 0.70 CRBN (0.56) DUTDDB1CRBNALDH1A1LMNA

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
WO-2006070292-A2 PYRIMIDINE COMPOUNDS AS ANTI-ICTOGENIC AND/OR ANTI-EPILEPTOGENIC AGENTS QUEEN'S UNIVERSITY AT KINGSTON (US) 2006-07-06 WO disclosed