SCHEMBL8076472

SCHEMBL8076472

Cc1ccc2nc([C@@H](C)NC(=O)OC(C)(C)C)sc2c1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47

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
SCHEMBL8071493 0.79 TRPA1 (0.47)
SCHEMBL17090573 0.78 LCK (0.69)
SCHEMBL29506738 0.78 LCK (0.69)
SCHEMBL11887309 0.77
SCHEMBL8071747 0.75 LCK (0.43) LIPG
SCHEMBL8060765 0.75 HDAC3 (0.46)
SCHEMBL24619657 0.74 KMT2A (0.44) LIPG
SCHEMBL5111381 0.71 AAK1 (0.47)
SCHEMBL6560408 0.71 HPGD (0.49) LIPG
SCHEMBL12591857 0.71 RAB9A (0.58)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775696-B1 AMINO ACID AMIDE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AGROHORTICULTURAL FUNGICIDE, AND FUNGICIDAL METHOD KUMIAI CHEMICAL INDUSTRY CO (JP) 2000-07-19 EP disclosed
US-5789428-A Amino-acid amide derivatives, processes for preparing the same, agricultural or horticultural fungicides, and method for killing fungi KUMIAI CHEMICAL INDUSTRY CO. LTD. (JP) 1998-08-04 US disclosed
EP-0775696-A1 AMINO ACID AMIDE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AGROHORTICULTURAL FUNGICIDE, AND FUNGICIDAL METHOD KumaiI Chemical Industry Co., Ltd. (JP) 1997-05-28 EP disclosed