SCHEMBL8988100

SCHEMBL8988100

C=C(F)n1ccc(=O)[nH]c1=O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.45
DDB1 Q16531 1/20 0.41
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.34
SLC28A1 O00337 1/20 0.33
SLC28A2 O43868 1/20 0.33
SLC29A1 Q99808 1/20 0.33
SLC28A3 Q9HAS3 1/20 0.33
DUT P33316 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL4231518 0.80 CRBN (0.45) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL24755086 0.80 CRBN (0.50) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL27581645 0.77 CRBN (0.50) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL2976955 0.75 CRBN (0.48) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL28132697 0.73 CRBN (0.47) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL7056290 0.73 CRBN (0.52) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL1398237 0.73 CRBN (0.42) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL20365469 0.71 CRBN (0.44) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL913153 0.68 TYMP (0.51) CRBNDDB1LMNAPKMDUT
SCHEMBL422813 0.67

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-0719271-A1 5-(1-FLUORO-VINYL)-1H-PYRIMIDINE-2,4-DIONE DERIVATIVES USEFUL AS ANTINEOPLASTIC AGENTS MERRELL PHARMACEUTICALS INC. (US) 1996-07-03 EP disclosed
WO-1995007917-A1 5-(1-FLUORO-VINYL)-1H-PYRIMIDINE-2,4-DIONE DERIVATIVES USEFUL AS ANTINEOPLASTIC AGENTS MERRELL PHARMACEUTICALS INC. (US) 1995-03-23 WO disclosed