SCHEMBL8988103

SCHEMBL8988103

O=c1ccn(C=CF)c(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.47
DDB1 Q16531 1/20 0.42
PKM P14618 1/20 0.35
DUT P33316 4/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
SLC28A1 O00337 1/20 0.31
SLC28A2 O43868 1/20 0.31
SLC29A1 Q99808 1/20 0.31
SLC28A3 Q9HAS3 1/20 0.31
ENPP1 P22413 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL3414870 0.79 CRBN (0.47) CRBNDDB1PKMDUTL3MBTL1
SCHEMBL7715133 0.79 CRBN (0.47) CRBNDDB1PKMDUTL3MBTL1
SCHEMBL9486303 0.79 CRBN (0.47) CRBNDDB1PKMDUTSLC28A1
SCHEMBL9486307 0.79 CRBN (0.47) CRBNDDB1PKMDUTSLC28A1
SCHEMBL2561871 0.78 CRBN (0.50) CRBNDDB1PKMDUTL3MBTL1
SCHEMBL7984568 0.78 CRBN (0.45) CRBNDDB1PKMDUTL3MBTL1
SCHEMBL7204552 0.77 CRBN (0.48) CRBNDDB1PKMDUTL3MBTL1
SCHEMBL19348252 0.75 CRBN (0.43) CRBNDDB1DUTL3MBTL1ALDH1A1
SCHEMBL19052857 0.68 CRBN (0.40) CRBNDDB1PKMDUTALDH1A1
SCHEMBL8790967 0.64

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