SCHEMBL8622497

SCHEMBL8622497

Brc1c(Br)c(Br)c2c(c1Br)Cc1ccccc1-2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K9 P80192 3/20 0.42
MAP3K11 Q16584 3/20 0.42
MAOA P21397 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
PNMT P11086 1/20 0.39
BCHE P06276 2/20 0.38
CES1 P23141 1/20 0.38
KDR P35968 3/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL28156824 0.77 NPC1 (0.46) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL30741433 0.77 MAP3K9 (0.55) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL22067694 0.77 MAP3K9 (0.55) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL29355432 0.77 MAP3K9 (0.55) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL6060999 0.76 PNMT (0.41) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL20382173 0.74 MAP3K9 (0.36) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL7166601 0.73 MAP3K9 (0.36) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL7166606 0.73 ADRA1D (0.34) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL784717 0.73 PNMT (0.46) MAP3K9MAP3K11MAOACA1CA2
SCHEMBL29453593 0.73 PNMT (0.46) MAP3K9MAP3K11MAOACA1CA2

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
EP-0671971-B1 MEMBRANES HAVING IMPROVED SELECTIVITY AND RECOVERY, AND PROCESS FOR MAKING SAME MG GENERON INC (US) 1998-06-10 EP disclosed
EP-0671971-A1 MEMBRANES HAVING IMPROVED SELECTIVITY AND RECOVERY, AND PROCESS FOR MAKING SAME MG GENERON, INC. (US) 1995-09-20 EP disclosed
US-5409524-A Heat treatment and ultraviolet irradiation THE DOW CHEMICAL COMPANY (US) 1995-04-25 US disclosed
WO-1994012269-A1 MEMBRANES HAVING IMPROVED SELECTIVITY AND RECOVERY, AND PROCESS FOR MAKING SAME THE DOW CHEMICAL COMPANY (US) 1994-06-09 WO disclosed