SCHEMBL32668636

SCHEMBL32668636

COc1cc(I)c(C=O)cc1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.58
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
TSHR P16473 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ERN1 O75460 5/20 0.47
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
MCL1 Q07820 1/20 0.41
PTPN1 P18031 2/20 0.41
TNFRSF1A P19438 1/20 0.41
LMNA P02545 3/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
TAAR1 Q96RJ0 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
SCHEMBL1589608 0.86 ALDH1A1 (0.65) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL1539323 0.84 ALDH1A1 (0.69) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL30665931 0.84 PRKDC (0.81) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL18270047 0.84 PRKDC (0.81) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL29655238 0.84 ALDH1A1 (0.69) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL28984397 0.81 PRKDC (0.48) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL2859718 0.81 PRKDC (0.58) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL2037836 0.80 PRKDC (0.74) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL698744 0.80 PRKDC (0.81) PRKDCALDH1A1KDM4ETSHRTDP1
SCHEMBL3268135 0.79 ERN1 (0.50) PRKDCALDH1A1KDM4ETSHRTDP1

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-4686723-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2026-02-04 EP disclosed