SCHEMBL7525729

SCHEMBL7525729

OC(=Cc1ccccn1)c1cccc(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.47
MAPK10 P53779 1/20 0.46
NFE2L2 Q16236 1/20 0.44
TSHR P16473 1/20 0.43
GAA P10253 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
ATM Q13315 1/20 0.41
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HSP90AA1 P07900 1/20 0.38
JAK2 O60674 1/20 0.37
P2RX7 Q99572 2/20 0.37
MAOA P21397 1/20 0.37
ERCC5 P28715 1/20 0.36
FEN1 P39748 1/20 0.36
GRM4 Q14833 1/20 0.36

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
SCHEMBL7517901 0.89 TDP1 (0.51) TDP1MAPK10NFE2L2KMT2AMEN1
SCHEMBL7520091 0.82 TDP1 (0.51) TDP1NFE2L2GAAKMT2AMEN1
SCHEMBL7523674 0.79 TDP1 (0.51) TDP1MAPK10KMT2AMEN1RAB9A
SCHEMBL7519789 0.77 TDP1 (0.46) TDP1NFE2L2KMT2AMEN1RAB9A
SCHEMBL7518895 0.77 TDP1 (0.46) TDP1NFE2L2TSHRKMT2AMEN1
SCHEMBL7526105 0.74 TDP1 (0.46) TDP1NFE2L2KMT2AMEN1RAB9A
SCHEMBL7521932 0.72 TDP1 (0.71) TDP1KMT2AMEN1RAB9ANPC1
SCHEMBL14611861 0.72 TDP1 (0.71) TDP1KMT2AMEN1RAB9ANPC1
SCHEMBL2094929 0.72 TSHR (0.59) MAPK10TSHRJAK2P2RX7ERCC5
SCHEMBL16597732 0.70 NPC1 (0.57) NFE2L2GAAKMT2AMEN1RAB9A

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-0937044-B1 CFTR CHANNEL ACTIVATOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME CENTRE NAT RECH SCIENT (FR) 2002-01-30 EP disclosed