SCHEMBL11247419

SCHEMBL11247419

CCCn1nc(-c2ccncc2)cc(C(=O)NN)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 2/20 0.42
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
CLK1 P49759 1/20 0.39
UBE2N P61088 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
CASP1 P29466 4/20 0.39
MAPK13 O15264 2/20 0.39
MAPK12 P53778 1/20 0.39
MAPK11 Q15759 1/20 0.39
MAPK14 Q16539 1/20 0.39
HDAC1 Q13547 1/20 0.38
MPO P05164 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL11231677 0.91 CNR1 (0.43) KDM4ERAB9ASMN1; SMN2MAPTCNR1
SCHEMBL11242637 0.90 KDM4E (0.46) KDM4ERAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL11241157 0.89 KDM4E (0.43) KDM4ERAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL11245569 0.88 CASP1 (0.46) MAPTALDH1A1HPGDMAPK1CLK1
SCHEMBL11246089 0.87 KDM4E (0.41) KDM4ERAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL11239782 0.86 GSK3B (0.41) MAPTALDH1A1HPGDMAPK1CLK1
SCHEMBL11246765 0.86 HDAC1 (0.41) KDM4ERAB9ASMN1; SMN2MAPTTP53
SCHEMBL11243333 0.85 KDM4E (0.47) KDM4ERAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL11241921 0.84 KDM4E (0.44) KDM4ERAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL11242680 0.83 KDM4E (0.45) KDM4ERAB9ASMN1; SMN2MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4346221-A Preparation of 4-amino-6-(pyridinyl)-3(2H)-pyridazinones from 6-(pyridinyl)-3(2H)-pyridazinones STERLING DRUG INC. (US) 1982-08-24 US disclosed
US-4338446-A Di-(lower-alkyl)hydroxy-[2-oxo-2-(pyridinyl)ethyl]-propanedioates STERLING DRUG INC. (US) 1982-07-06 US disclosed
US-4305943-A 4-Amino-6-(pyridinyl)-3(2H)-pyridazinones and their use as cardiotonics STERLING DRUG INC. (US) 1981-12-15 US disclosed
US-4304776-A 4-Substituted-6-(pyridinyl)-3(2h)-pyridazinones and their use as intermediates and cardiotonics STERLING DRUG INC. (US) 1981-12-08 US disclosed