SCHEMBL289873

SCHEMBL289873

O=c1[nH]cc(I)c(=O)[nH]1.O=c1[nH]cc(I)c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPYD Q12882 5/20 1.00
MAPT P10636 3/20 0.52
ALDH1A1 P00352 2/20 0.52
GAA P10253 2/20 0.52
LMNA P02545 2/20 0.52
ATAD2 Q6PL18 1/20 0.52
CYP19A1 P11511 1/20 0.52
TSHR P16473 1/20 0.52
THPO P40225 1/20 0.52
MTOR P42345 1/20 0.52
HTT P42858 1/20 0.52
HBB P68871 1/20 0.52
PMP22 Q01453 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PKM P14618 1/20 0.41
KDM4C Q9H3R0 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
SCHEMBL7884 1.00
5-Bromouracil SCHEMBL8224638 0.87 DPYD (0.76) DPYDMAPTALDH1A1GAALMNA
SCHEMBL7250168 0.87 DPYD (0.76) DPYDMAPTALDH1A1GAALMNA
SCHEMBL14793573 0.81 DPYD (0.66) DPYDMAPTALDH1A1GAALMNA
Hypoxanthine SCHEMBL22323646 0.80 DPYD (0.63) DPYDMAPTALDH1A1GAALMNA
SCHEMBL5801644 0.72 ALDH1A1 (0.64) DPYDMAPTALDH1A1GAALMNA
SCHEMBL6573722 0.70
SCHEMBL6555485 0.69 DPYD (0.52) DPYDMAPTALDH1A1GAALMNA
SCHEMBL7177835 0.69 DPYD (0.52) DPYDMAPTALDH1A1GAALMNA
SCHEMBL2304446 0.68

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-2428201-A1 Oral administration of nucleoside monophosphates Merck Serono S.A. (CH) 2012-03-14 EP disclosed