SCHEMBL12658735

SCHEMBL12658735

Bc1ccc2c(c1)c(=O)oc1cc(Br)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 1/20 0.49
▸ MAPT P10636 3/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ STAT1 P42224 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ PKM P14618 2/20 0.44
▸ ALPL P05186 1/20 0.44
▸ ALPI P09923 1/20 0.44
▸ ESR2 Q92731 2/20 0.43
▸ PKLR P30613 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ ESR1 P03372 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CA12 O43570 2/20 0.37

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
SCHEMBL13070979 0.93 PDE2A (0.49) PDE2AMAPTKDM4EALDH1A1NPC1
SCHEMBL205534 0.88 PDE2A (0.56) PDE2AMAPTKDM4EALDH1A1NPC1
SCHEMBL19417396 0.82 MAPT (0.40) MAPTKDM4EALDH1A1NPC1RAB9A
SCHEMBL16797962 0.81 NPSR1 (0.64) PDE2AMAPTKDM4EALDH1A1NPC1
SCHEMBL26766495 0.80 ESR2 (0.50) PDE2AMAPTKDM4EALDH1A1NPC1
SCHEMBL26768842 0.80 PDE2A (0.77) PDE2AMAPTKDM4EALDH1A1POLB
SCHEMBL14163793 0.77 ESR2 (0.54) PDE2AMAPTKDM4EALDH1A1NPC1
SCHEMBL29853658 0.77 PDE2A (0.77) PDE2AMAPTKDM4EALDH1A1POLB
SCHEMBL15388144 0.77 PDE2A (0.77) PDE2AMAPTKDM4EALDH1A1POLB
SCHEMBL12673559 0.76 MAPT (0.45) PDE2AMAPTKDM4EALDH1A1NPC1

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-2325225-A1 Complex aryl copolymer compounds and polymer light emitting devices made by using the same Sumitomo Chemical Company, Limited (JP) 2011-05-25 — — EP disclosed
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