SCHEMBL9779162

SCHEMBL9779162

CC(O)C(=NNC(=O)c1ccccn1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 4/20 0.57
▸ RAB9A P51151 9/20 0.56
▸ NPC1 O15118 8/20 0.56
▸ GAA P10253 6/20 0.56
▸ KMT2A Q03164 5/20 0.56
▸ SMN1; SMN2 Q16637 4/20 0.56
▸ MAPT P10636 3/20 0.55
▸ ALDH1A1 P00352 4/20 0.52
▸ PKM P14618 3/20 0.52
▸ POLB P06746 2/20 0.52
▸ NCOA1 Q15788 1/20 0.52
▸ NCOA3 Q9Y6Q9 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ HPGD P15428 2/20 0.51
▸ OPRK1 P41145 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ KDM4E B2RXH2 3/20 0.50
▸ HTT P42858 3/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ LMNA P02545 2/20 0.50

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
SCHEMBL9779577 0.81 GAA (0.57) RAB9ANPC1GAAKMT2ASMN1; SMN2
SCHEMBL12720823 0.79 AGTR1 (0.88) AGTR1RAB9ANPC1GAAKMT2A
SCHEMBL9779169 0.78 ALDH1A1 (0.60) AGTR1RAB9ANPC1GAAKMT2A
SCHEMBL12720841 0.76 RAB9A (0.88) AGTR1RAB9ANPC1GAAKMT2A
SCHEMBL30873792 0.76 RAB9A (0.72) AGTR1RAB9ANPC1GAAKMT2A
SCHEMBL12720817 0.75 NPC1 (0.76) AGTR1RAB9ANPC1GAAKMT2A
SCHEMBL12720802 0.75 AGTR1 (0.71) AGTR1RAB9ANPC1GAAKMT2A
SCHEMBL24835694 0.74 RAB9A (0.60) AGTR1RAB9ANPC1GAAKMT2A
SCHEMBL30777268 0.74 RAB9A (0.60) AGTR1RAB9ANPC1GAAKMT2A
SCHEMBL12720857 0.74 RAB9A (0.78) AGTR1RAB9ANPC1GAAKMT2A

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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