SCHEMBL27851745

SCHEMBL27851745

NNC(=O)c1cc(-c2cn(Cc3ccccc3)c3ccccc23)nn1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 5/20 0.55
▸ CA1 P00915 5/20 0.55
▸ CA2 P00918 5/20 0.55
▸ CA9 Q16790 5/20 0.55
▸ PDE4A P27815 5/20 0.52
▸ PDE4B Q07343 5/20 0.52
▸ PDE4C Q08493 5/20 0.52
▸ PDE4D Q08499 5/20 0.52
▸ PDE3B Q13370 4/20 0.52
▸ PDE3A Q14432 4/20 0.52
▸ SIRT2 Q8IXJ6 1/20 0.46
▸ CHRM1 P11229 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ F2RL3 Q96RI0 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ADORA1 P30542 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
SCHEMBL27831428 0.90 CA12 (0.61) CA12CA1CA2CA9PDE4A
SCHEMBL27833748 0.89 CA12 (0.63) CA12CA1CA2CA9PDE4A
SCHEMBL28787743 0.89 CA12 (0.60) CA12CA1CA2CA9PDE4A
SCHEMBL27851691 0.88 CA12 (0.47) CA12CA1CA2CA9LMNA
SCHEMBL27811136 0.87 CA12 (0.65) CA12CA1CA2CA9PDE4A
SCHEMBL27811519 0.83 CA12 (0.55) CA12CA1CA2CA9PDE4A
SCHEMBL27811239 0.82 CA12 (0.72) CA12CA1CA2CA9PDE4A
SCHEMBL27811450 0.82 CA12 (0.58) CA12CA1CA2CA9PDE4A
SCHEMBL28787781 0.81 CA12 (0.72) CA12CA1CA2CA9PDE4A
SCHEMBL27706437 0.80 SMN1; SMN2 (0.63) LMNAALDH1A1SMN1; SMN2L3MBTL1

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
CN-102321074-B Indole ring-substituted pyrazole hydrazide derivative and preparation method and application thereof SHANDONG INST LIGHT INDUSTRY 2013-04-10 — — CN claimed
CN-102321074-A Indole ring-substituted pyrazole hydrazide derivative and preparation method and application thereof SHANDONG INST LIGHT INDUSTRY 2012-01-18 — — CN claimed
CN-102321074-B Indole ring-substituted pyrazole hydrazide derivative and preparation method and application thereof SHANDONG INST LIGHT INDUSTRY 2013-04-10 — — CN disclosed
CN-102321074-A Indole ring-substituted pyrazole hydrazide derivative and preparation method and application thereof SHANDONG INST LIGHT INDUSTRY 2012-01-18 — — CN disclosed
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