SCHEMBL9779577

SCHEMBL9779577

CC(O)C(=NNC(=O)c1ccncc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 5/20 0.57
▸ MAPT P10636 4/20 0.55
▸ CYP3A4 P08684 2/20 0.51
▸ KDM4E B2RXH2 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ GLA P06280 1/20 0.49
▸ POLB P06746 1/20 0.47
▸ MTOR P42345 1/20 0.47
▸ JAK2 O60674 1/20 0.46
▸ TYK2 P29597 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46

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
SCHEMBL9779169 0.86 ALDH1A1 (0.60) GAAMAPTKDM4EHTTMEN1
SCHEMBL9779162 0.81 AGTR1 (0.57) GAAMAPTKDM4EHTTMEN1
Isonicotinoylhydrazone Of Acetophenone SCHEMBL6637701 0.79 GAA (0.76) GAAMAPTCYP3A4KDM4EMEN1
Isonicotinoylhydrazone Of Acetophenone SCHEMBL6637694 0.79 GAA (0.76) GAAMAPTCYP3A4KDM4EMEN1
SCHEMBL6687709 0.79 GAA (0.66) GAAMAPTCYP3A4KDM4EHTT
SCHEMBL14413395 0.79 GAA (0.66) GAAMAPTCYP3A4KDM4EHTT
SCHEMBL1514859 0.76 POLB (0.68) GAAMAPTCYP3A4KDM4EHTT
SCHEMBL1514861 0.76 POLB (0.68) GAAMAPTCYP3A4KDM4EHTT
SCHEMBL2996962 0.75 GAA (0.54) GAAMAPTCYP3A4KDM4EKMT2A
SCHEMBL2998191 0.74 GAA (0.56) GAAMAPTCYP3A4KDM4EKMT2A

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
US-5066695-A Plastics; heat resistance, dispersibility CIBA-GEIGY CORPORATION (US) 1991-11-19 — — US disclosed
EP-0349489-A2 Organic macromolecular material containing a hydrazone-based metal complex pigment CIBA-GEIGY AG (CH) 1990-01-03 — — EP disclosed
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