SCHEMBL6720850

SCHEMBL6720850

Oc1c(I)cc2c(I)c(O)c(I)cc2c1I

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.50
ALB P02768 1/20 0.40
MEN1 O00255 3/20 0.37
LMNA P02545 3/20 0.37
HTT P42858 3/20 0.37
KMT2A Q03164 3/20 0.37
ERN1 O75460 1/20 0.36
TDP1 Q9NUW8 3/20 0.35
MAPK14 Q16539 2/20 0.35
KDM4E B2RXH2 2/20 0.35
USP2 O75604 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 2/20 0.35
HSP90AA1 P07900 2/20 0.35
HPGD P15428 2/20 0.35
ALOX15 P16050 2/20 0.35
SLC6A2 P23975 2/20 0.35
MAPK1 P28482 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HIF1A Q16665 2/20 0.35

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
SCHEMBL69776 0.80 TTR (0.56) TTRALBMEN1LMNAHTT
SCHEMBL6731780 0.80 TPMT (0.41) TTRALBMEN1LMNAHTT
SCHEMBL12817414 0.75 TTR (0.50) TTRALBMEN1LMNAHTT
SCHEMBL19428392 0.73 TTR (0.65) TTRALBMEN1LMNAHTT
SCHEMBL10891717 0.73 TTR (0.48) TTRALBMEN1LMNAHTT
SCHEMBL8410940 0.73 TTR (0.48) TTRALBMEN1LMNAHTT
SCHEMBL19880365 0.71 ESR1 (0.36) TTRLCK
SCHEMBL18855325 0.71 TTR (0.61) TTRALBMEN1LMNAHTT
SCHEMBL7929436 0.69 TTR (0.39) TTRALBMEN1LMNAHTT
SCHEMBL7929410 0.69 TTR (0.43) TTRALBMEN1LMNAHTT

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
US-6677473-B1 TREATMENT, PREVENTION OR AMELIORATION OF ONE OR MORE SYMPTOMS OF THROMBOTIC DISORDERS, UNSTABLE ANGINA OR CANCER CORVAS INTERNATIONAL INC 2004-01-13 US disclosed