SCHEMBL8580696

SCHEMBL8580696

O=C1CC2CCc3ccccc3C2=NN1c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
MAPT P10636 3/20 0.48
GAA P10253 2/20 0.48
GLA P06280 1/20 0.48
MAPK1 P28482 1/20 0.48
CASP3 P42574 1/20 0.48
RECQL P46063 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 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
SCHEMBL8607232 0.89 GABRP (0.46) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL10365811 0.88 MAPT (0.41) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL10366098 0.86 ALDH1A1 (0.43) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL7287680 0.86 ALDH1A1 (0.43) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL8124757 0.85 ALDH1A1 (0.39) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL10367579 0.85 PRKCZ (0.41) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL8124342 0.85 ALDH1A1 (0.39) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL10367467 0.85 MAPT (0.44) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL10365659 0.84 GRM5 (0.38) ALDH1A1KDM4ENPC1RAB9AMAPT
SCHEMBL10368105 0.82 MAPT (0.41) ALDH1A1KDM4ENPC1RAB9AMAPT

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
WO-1998009969-A1 NOVEL ARYL-PYRIDAZINES ASTRA PHARMACEUTICALS LTD. (GB) 1998-03-12 WO disclosed