SCHEMBL9589711

SCHEMBL9589711

Cc1cc2nc(C(=O)NCP(=O)(O)O)[nH]c2cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 3/20 0.56
▸ HRH4 Q9H3N8 1/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.45
▸ PDE3B Q13370 1/20 0.39
▸ PDE3A Q14432 1/20 0.39
▸ CACNA1G O43497 1/20 0.38
▸ F9 P00740 3/20 0.37
▸ GRIN2D O15399 2/20 0.37
▸ GRIN3B O60391 2/20 0.37
▸ GRIN1 Q05586 2/20 0.37
▸ GRIN2A Q12879 2/20 0.37
▸ GRIN2B Q13224 2/20 0.37
▸ GRIN2C Q14957 2/20 0.37
▸ GRIN3A Q8TCU5 2/20 0.37
▸ GRIA1 P42261 1/20 0.37
▸ GRIA2 P42262 1/20 0.37
▸ GRIA3 P42263 1/20 0.37
▸ GRIA4 P48058 1/20 0.37
▸ RHEB Q15382 1/20 0.37
▸ MMP13 P45452 1/20 0.36

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
SCHEMBL4954498 0.73 FAAH (0.51) EGLN1ABL1
SCHEMBL4309470 0.72 EGLN1 (1.00) EGLN1HRH4HRH3CACNA1GGRIN2D
SCHEMBL4303435 0.69 EGLN1 (0.65) EGLN1HRH4HRH3
SCHEMBL13914872 0.68 HRH4 (0.52) HRH4HRH3
SCHEMBL13914871 0.68 HRH4 (0.68) HRH4HRH3
SCHEMBL9589724 0.68 EGLN1 (0.41) EGLN1HRH4HRH3CACNA1GGRIN2D
SCHEMBL1260113 0.67 EGLN1 (0.43) EGLN1PDE3BPDE3AGRIN2DGRIN3B
SCHEMBL1440395 0.66 GRIN2D (0.47) PDE3BPDE3ACACNA1GGRIN2DGRIN3B
SCHEMBL12020717 0.66 ALDH1A1 (0.56) PDE3BPDE3AGRIN2DGRIN3BGRIN1
SCHEMBL25768258 0.66 HRH4 (0.57) EGLN1HRH4HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5216003-A Antihypoxic, antiischemic agents G. D. SEARLE & CO. (US) 1993-06-01 — — US disclosed
Send feedback