SCHEMBL7464969

SCHEMBL7464969

Clc1ccc2c(Oc3ccccc3Br)ccnc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.49
MAPT P10636 4/20 0.48
KMT2A Q03164 3/20 0.48
POLB P06746 2/20 0.48
PLA2G1B P04054 1/20 0.48
XBP1 P17861 1/20 0.48
OPRM1 P35372 1/20 0.48
OPRD1 P41143 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48
LMNA P02545 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
THRB P10828 1/20 0.47
NR4A2 P43354 1/20 0.46
SOS2 Q07890 1/20 0.46
NPC1 O15118 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 1/20 0.44
GLA P06280 1/20 0.44

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
SCHEMBL7529202 0.86 NR4A2 (0.59) APPMAPTKMT2APOLBLMNA
SCHEMBL7464868 0.85 MAPT (0.54) APPMAPTKMT2APOLBLMNA
SCHEMBL7466303 0.85 LMNA (0.45) APPMAPTKMT2APOLBLMNA
SCHEMBL7464035 0.84 MAPK1 (0.50) APPMAPTKMT2APOLBXBP1
SCHEMBL7468141 0.83 APP (0.49) APPMAPTKMT2APOLBLMNA
SCHEMBL7466204 0.83 APP (0.49) APPMAPTKMT2APOLBLMNA
SCHEMBL7461008 0.83 NPC1 (0.58) APPMAPTPOLBLMNASMN1; SMN2
SCHEMBL7458619 0.83 APP (0.52) APPMAPTKMT2APOLBPLA2G1B
SCHEMBL27312782 0.83 APP (0.49) APPMAPTKMT2APOLBLMNA
SCHEMBL7461560 0.83 LMNA (0.51) APPMAPTKMT2APOLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0326330-B1 Quinoline fungicides DOW AGROSCIENCES LLC (US) 2002-07-24 EP claimed
US-5145843-A For plants DOWELANCO (US) 1992-09-08 US claimed
EP-0326330-B1 Quinoline fungicides DOW AGROSCIENCES LLC (US) 2002-07-24 EP disclosed
US-5240940-A Synergistic nmixture DOWELANCO (US) 1993-08-31 US disclosed
US-5145843-A For plants DOWELANCO (US) 1992-09-08 US disclosed
EP-0326330-A2 Quinoline, quinazoline, and cinnoline fungicides DowElanco (US) 1989-08-02 EP disclosed