SCHEMBL9779169

SCHEMBL9779169

CC(O)C(=NNC(=O)c1cccnc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ KDM4E B2RXH2 1/20 0.60
▸ GAA P10253 3/20 0.54
▸ MAPT P10636 2/20 0.54
▸ GFER P55789 1/20 0.51
▸ RAB9A P51151 5/20 0.51
▸ NPC1 O15118 4/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ AGTR1 P30556 1/20 0.51
▸ OPRK1 P41145 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ AHR P35869 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ LMNA P02545 1/20 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 0.86 GAA (0.57) ALDH1A1KMT2AKDM4EGAAMAPT
SCHEMBL9779162 0.78 AGTR1 (0.57) ALDH1A1KMT2AKDM4EGAAMAPT
SCHEMBL27178272 0.77 GAA (0.86) ALDH1A1KMT2AKDM4EGAAMAPT
SCHEMBL27178276 0.77 GAA (0.86) ALDH1A1KMT2AKDM4EGAAMAPT
SCHEMBL31141986 0.76 KDM4E (0.67) ALDH1A1KMT2AKDM4EGAAMAPT
SCHEMBL29158233 0.76 KDM4E (0.67) ALDH1A1KMT2AKDM4EGAAMAPT
SCHEMBL29011921 0.74 GAA (0.71) ALDH1A1KMT2AGAARAB9ANPC1
SCHEMBL9973629 0.73 CTRC (0.59) ALDH1A1KMT2AKDM4EGAAMAPT
SCHEMBL11868047 0.73 HDAC1 (0.61) ALDH1A1KMT2AGAARAB9ANPC1
SCHEMBL11186049 0.73 ALDH1A1 (0.66) ALDH1A1KMT2AKDM4EGAAMAPT

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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