SCHEMBL9872964

SCHEMBL9872964

CCOC(=O)c1c(-c2cccc([N+](=O)[O-])c2)cc(-c2ccccc2)nc1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.60
ALDH1A1 P00352 7/20 0.60
MAPK1 P28482 1/20 0.60
SMN1; SMN2 Q16637 3/20 0.54
RAB9A P51151 2/20 0.54
LMNA P02545 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
HPGD P15428 2/20 0.54
KDM4E B2RXH2 1/20 0.54
NPC1 O15118 1/20 0.54
GAA P10253 1/20 0.54
PDE4B Q07343 1/20 0.53
PDE4D Q08499 1/20 0.53
ACHE P22303 2/20 0.51
CACNB4 O00305 1/20 0.51
CACNA1A O00555 1/20 0.51
CACNA1G O43497 1/20 0.51
CACNG3 O60359 1/20 0.51
CACNA1F O60840 1/20 0.51
CACNA1H O95180 1/20 0.51

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
SCHEMBL9874432 0.92 MAPT (0.56) MAPTALDH1A1MAPK1SMN1; SMN2RAB9A
SCHEMBL9874545 0.90 PRKCZ (0.54) MAPTALDH1A1MAPK1SMN1; SMN2RAB9A
SCHEMBL10377726 0.89 ALDH1A1 (0.56) MAPTALDH1A1MAPK1SMN1; SMN2PDE4D
SCHEMBL9779315 0.88 MAPT (0.59) MAPTALDH1A1MAPK1SMN1; SMN2RAB9A
SCHEMBL9779333 0.88 MAPT (0.61) MAPTALDH1A1MAPK1SMN1; SMN2RAB9A
SCHEMBL9873424 0.88 MAPT (0.56) MAPTALDH1A1MAPK1SMN1; SMN2RAB9A
SCHEMBL9874282 0.86 MAPT (0.55) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL2075279 0.83 MAPT (0.57) MAPTALDH1A1MAPK1SMN1; SMN2RAB9A
SCHEMBL7421872 0.82 MAPT (0.63) MAPTALDH1A1MAPK1SMN1; SMN2RAB9A
SCHEMBL9779335 0.82 MAPT (0.56) MAPTALDH1A1MAPK1SMN1; SMN2RAB9A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4990507-A Cardiotonic agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-02-05 US disclosed
EP-0228845-B1 N-CONTAINING HETEROCYCLIC COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF AND COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-12-12 EP disclosed
US-4931453-A CARDIOVASCULAR, HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1990-06-05 US disclosed
US-4857527-A HYPOTENSIVE, ANTISCHEMIC AGENT FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 US disclosed
US-4831030-A FOR CEREBROVASCULAR DISEASES; HYPERTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 US disclosed
EP-0228845-A2 N-containing heterocyclic compounds, processes for the preparation thereof and composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-07-15 EP disclosed