SCHEMBL7329951

SCHEMBL7329951

O=C1C(O)N(O)c2ccccc2N1CCN1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
KDM1A O60341 3/20 0.49
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
HKDC1 Q2TB90 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
ALDH3A1 P30838 1/20 0.43

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
SCHEMBL7331291 0.74 ALDH1A1 (0.50) L3MBTL1KDM4EMAPTALDH1A1LMNA
SCHEMBL7330405 0.73 TRPA1 (0.39) LMNA
SCHEMBL8563447 0.72 KDM1A (0.45) KDM1AKDM4EMAPT
SCHEMBL7324240 0.71 MEN1 (0.57) L3MBTL1ALDH1A1MEN1POLBKMT2A
SCHEMBL29924011 0.69 CHRM2 (0.47) KDM1AKDM4EMAPT
SCHEMBL9044824 0.69 HTR7 (0.66) KDM1A
SCHEMBL4624294 0.69 ALDH1A1 (0.78) KDM1AKDM4EMAPTALDH1A1CA1
SCHEMBL8564644 0.69 CCKBR (0.49) KDM1AKDM4EMAPT
SCHEMBL8556230 0.68 GRM5 (0.66) L3MBTL1KDM4EMAPTALDH1A1LMNA
SCHEMBL29525355 0.68 DRD2 (0.67) POLB

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-5075304-A Nervous system disorders NOVO NORDISK A/S (DK) 1991-12-24 US disclosed
EP-0344943-A1 Imidazoquinoxaline compounds and their preparation and use NOVO NORDISK A/S (DK) 1989-12-06 EP disclosed