Sugi Predict

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SCHEMBL4355319

SCHEMBL4355319

NC(=O)[C@H](Cc1ccc(-c2ccccc2)cc1)NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 3/20 0.47
▸ MME P08473 9/20 0.47
▸ ACE2 Q9BYF1 8/20 0.47
▸ ACE P12821 7/20 0.47
▸ SRR Q9GZT4 2/20 0.47
▸ PSAT1 Q9Y617 2/20 0.47
▸ CPA1 P15085 6/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.44
▸ MMP2 P08253 3/20 0.43
▸ MMP9 P14780 2/20 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
SCHEMBL6949191 0.80 NPSR1 (0.62) MMEACE2ACECPA1NPSR1
SCHEMBL7517173 0.80 NPSR1 (0.62) MMEACE2ACECPA1NPSR1
SCHEMBL28290972 0.80 NPSR1 (0.62) MMEACE2ACECPA1NPSR1
SCHEMBL224241 0.80 MAPT (0.39) NPSR1
SCHEMBL26909780 0.78 HPGDS (0.58) HPGDSMMEACE2ACESRR
SCHEMBL4348297 0.78 HPGDS (0.58) HPGDSMMEACE2ACESRR
SCHEMBL6212171 0.78 NPSR1 (0.52) MMEACE2ACECPA1NPSR1
SCHEMBL14343041 0.78 NPSR1 (0.52) MMEACE2ACECPA1NPSR1
SCHEMBL13821433 0.77 TAAR1 (0.44) MMEACESRRPSAT1
SCHEMBL6414895 0.76 EPHX1 (0.50) HPGDSMMEACE2ACENPSR1

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
EP-2070928-A1 7-azaindol-3-ylacrylamides active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2009-06-17 — — EP disclosed
EP-2070928-A1 7-azaindol-3-ylacrylamides active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2009-06-17 — — EP disclosed