SCHEMBL29115014

SCHEMBL29115014

Oc1ccccc1-c1ccnnc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.40
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 3/20 0.39
BCL2L1 Q07817 1/20 0.39
KMT2A Q03164 4/20 0.38
CCNB2 O95067 1/20 0.37
CDK1 P06493 1/20 0.37
CCNB1 P14635 1/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
CCNB3 Q8WWL7 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 3/20 0.36
MAPT P10636 2/20 0.36
ALOX15 P16050 2/20 0.36
NFKB1 P19838 2/20 0.36
ALOX12 P18054 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
SCHEMBL3962961 0.76 NPC1 (0.48) IDO1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL25274620 0.74 CYP2A6 (0.43) ALDH1A1HPGDHSD17B10BCL2L1KMT2A
SCHEMBL20406101 0.73 ALDH1A1 (0.43) ALDH1A1HPGDHSD17B10KMT2ACCNB2
SCHEMBL8957712 0.72
SCHEMBL30442890 0.71 ALDH1A1 (0.67) IDO1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL29623192 0.71 ALDH1A1 (0.67) IDO1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL28574 0.71 ALDH1A1 (0.67) IDO1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL27659427 0.71 ALDH1A1 (0.67) IDO1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL13907548 0.71 KMT2A (0.46) IDO1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL1456413 0.69 KDM4E (0.48) ALDH1A1HPGDHSD17B10SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117143028-B Hydroxyphenyl pyridazine Mannich base compound, and preparation method and application thereof 四川大学 2024-12-20 CN claimed
CN-117143027-B 3-Benzyloxy-6-hydroxyphenylpyridazine compound as well as preparation method and application thereof 四川大学 2024-12-20 CN claimed
CN-117143027-A 3-benzyloxy-6-hydroxyphenylpyridazine compound as well as preparation method and application thereof 四川大学 2023-12-01 CN claimed
CN-117143028-A Hydroxyphenyl pyridazine Mannich base compound, and preparation method and application thereof 四川大学 2023-12-01 CN claimed
CN-117143028-B Hydroxyphenyl pyridazine Mannich base compound, and preparation method and application thereof 四川大学 2024-12-20 CN disclosed
CN-117143027-B 3-Benzyloxy-6-hydroxyphenylpyridazine compound as well as preparation method and application thereof 四川大学 2024-12-20 CN disclosed
CN-117143028-A Hydroxyphenyl pyridazine Mannich base compound, and preparation method and application thereof 四川大学 2023-12-01 CN disclosed
CN-117143027-A 3-benzyloxy-6-hydroxyphenylpyridazine compound as well as preparation method and application thereof 四川大学 2023-12-01 CN disclosed