SCHEMBL11244459

SCHEMBL11244459

Oc1ccc(Oc2ccc(I)cc2Cl)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK39 Q9UEW8 1/20 0.46
TAAR5 O14804 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
HSPD1 P10809 1/20 0.43
PNLIP P16233 1/20 0.43
PIK3CA P42336 1/20 0.43
HTT P42858 1/20 0.43
BLM P54132 1/20 0.43
HSPE1 P61604 1/20 0.43
MAPK1 P28482 1/20 0.42
APP P05067 1/20 0.41
NR1I2 O75469 1/20 0.41
LMNA P02545 1/20 0.41
TTR P02766 1/20 0.41
PGR P06401 1/20 0.41
HSP90AA1 P07900 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
SCHEMBL29084767 0.89 MEN1 (0.43) STK39TAAR5TAAR1MEN1KMT2A
SCHEMBL9623553 0.85 MEN1 (0.52) STK39MEN1KMT2AESR1ESR2
SCHEMBL11683912 0.83 MEN1 (0.56) STK39MEN1KMT2AESR1ESR2
SCHEMBL3469104 0.81 TTR (0.61) STK39MEN1KMT2APNLIPMAPK1
SCHEMBL28345487 0.80 TTR (0.59) STK39MEN1KMT2APNLIPMAPK1
SCHEMBL29137117 0.79 HDAC8 (0.37) MEN1KMT2AHSPD1PNLIPPIK3CA
SCHEMBL10664102 0.79 TAAR5 (0.49) TAAR5TAAR1MEN1KMT2AESR1
SCHEMBL10703684 0.79 PDE7A (0.53) STK39TAAR5TAAR1MEN1KMT2A
SCHEMBL8683893 0.79 STK39 (0.46) STK39MEN1KMT2AESR1ESR2
SCHEMBL29084824 0.78 TTR (0.52) STK39MEN1KMT2APNLIPNR1I2

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-4365991-A HERBICIDES HOFFMANN-LA ROCHE INC. (US) 1982-12-28 US disclosed