SCHEMBL29469595

SCHEMBL29469595

Oc1c(Oc2ccc(Br)cc2Br)cc(Br)c(Br)c1Br

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 9/20 1.00
AKR1B1 P15121 6/20 0.74
MEN1 O00255 1/20 0.68
LMNA P02545 1/20 0.68
MAPT P10636 1/20 0.68
HPGD P15428 1/20 0.68
HTT P42858 1/20 0.68
KMT2A Q03164 1/20 0.68
ATM Q13315 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
ALOX12 P18054 5/20 0.67
MAPK1 P28482 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
ALDH1A1 P00352 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
TSHR P16473 1/20 0.63

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
SCHEMBL5531128 1.00 ALOX15 (1.00) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL21528315 0.85 ALOX15 (0.73) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL30298316 0.85 ALOX15 (0.73) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL29367556 0.82 MAPK1 (1.00) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL899494 0.82 MAPK1 (1.00) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL30298315 0.81 MEN1 (1.00) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL30298313 0.81 MEN1 (1.00) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL30298317 0.81 MEN1 (1.00) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL29469602 0.79 MAPK1 (0.71) ALOX15AKR1B1MEN1LMNAMAPT
SCHEMBL5527228 0.79 ALOX15 (1.00) ALOX15AKR1B1MEN1LMNAMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11908550-B2 Method for determining different PBDEs derivatives from their response to activities of enoyl-ACP reductase NANJING UNIVERSITY (CN) 2024-02-20 US claimed
US-20220119850-A1 Method for determining different PBDEs derivatives from their response to activities of enoyl-ACP reductase NANJING UNIVERSITY (CN) 2022-04-21 US claimed
US-11908550-B2 Method for determining different PBDEs derivatives from their response to activities of enoyl-ACP reductase NANJING UNIVERSITY (CN) 2024-02-20 US disclosed
US-20220119850-A1 Method for determining different PBDEs derivatives from their response to activities of enoyl-ACP reductase NANJING UNIVERSITY (CN) 2022-04-21 US disclosed