SCHEMBL8134591

SCHEMBL8134591

O=C1CC2CCCc3ccncc3C2=NN1c1ccc(Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
MAPT P10636 3/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GABRA1 P14867 2/20 0.35
GABRG2 P18507 2/20 0.35
GABRB3 P28472 2/20 0.35
GABRA3 P34903 2/20 0.35
GAA P10253 1/20 0.34
ALOX12 P18054 1/20 0.34
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33

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
SCHEMBL8124342 0.93 ALDH1A1 (0.39) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8136984 0.89 KDM4E (0.38) ALDH1A1MAPTKMT2ACYP17A1CA12
SCHEMBL8124757 0.84 ALDH1A1 (0.39) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8128871 0.80 CACNA1B (0.38) CYP17A1FPR1FPR2CYP11B2
SCHEMBL8127824 0.79 KCNH2 (0.39) ALDH1A1MAPTLMNAGABRA1GABRG2
SCHEMBL8580696 0.78 ALDH1A1 (0.48) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8152879 0.78 LMNA (0.37) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8840949 0.78 ACHE (0.43) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL10365811 0.76 MAPT (0.41) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL10367467 0.76 MAPT (0.44) ALDH1A1MAPTLMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015450-A1 NOVEL PYRIDAZINE COMPOUNDS AstraZeneca UK Limited (GB) 2000-07-05 EP disclosed
WO-1997045428-A1 NOVEL PYRIDAZINE COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1997-12-04 WO disclosed