SCHEMBL22890844

SCHEMBL22890844

Oc1ccc(-c2cc(-c3cccc(P)c3)[nH]n2)cc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.65
MAPT P10636 7/20 0.48
ALOX15 P16050 7/20 0.48
HPGD P15428 5/20 0.48
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
LMNA P02545 4/20 0.48
RAB9A P51151 4/20 0.48
HSP90AA1 P07900 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 3/20 0.48
HTT P42858 1/20 0.48
MAPK1 P28482 4/20 0.47
TP53 P04637 3/20 0.47
KDM4E B2RXH2 1/20 0.47
GLA P06280 1/20 0.47
POLB P06746 1/20 0.46
ALOX12 P18054 2/20 0.46
NFKB1 P19838 2/20 0.46

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
SCHEMBL560667 0.86 APP (0.73) APPMAPTALOX15HPGDMEN1
Bromide SCHEMBL1660202 0.85 APP (0.71) APPMAPTALOX15HPGDMEN1
SCHEMBL15425076 0.83 APP (0.69) APPMAPTALOX15HPGDMEN1
SCHEMBL1659208 0.83 MAPT (0.68) APPMAPTALOX15HPGDMEN1
SCHEMBL16500504 0.83 APP (0.65) APPMAPTALOX15HPGDMEN1
SCHEMBL8002529 0.83 MAPT (0.68) APPMAPTALOX15HPGDMEN1
SCHEMBL31660327 0.83 MAPT (0.68) APPMAPTALOX15HPGDMEN1
SCHEMBL26095496 0.83 MAPT (0.68) APPMAPTALOX15HPGDMEN1
SCHEMBL31659862 0.83 MAPT (0.68) APPMAPTALOX15HPGDMEN1
SCHEMBL26096016 0.80 APP (0.60) APPMAPTALOX15HPGDMEN1

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-2307381-B1 NEW DRUGS FOR INHIBITING AGGREGATION OF PROTEINS INVOLVED IN DISEASES LINKED TO PROTEIN AGGREGATION AND/OR NEURODEGENERATIVE DISEASES UNIV MUENCHEN LUDWIG MAXIMILIANS (DE) 2021-01-13 EP disclosed