SCHEMBL9615214

SCHEMBL9615214

C=CCC1=CC(=O)N(c2ccccc2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.41
GAA P10253 2/20 0.36
ALDH1A1 P00352 6/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ELANE P08246 1/20 0.35
CES2 O00748 1/20 0.35
BCHE P06276 1/20 0.35
CES1 P23141 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GRK5 P34947 1/20 0.34
TYRO3 Q06418 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
FAAH O00519 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
CASP1 P29466 1/20 0.33
CASP3 P42574 1/20 0.33
CASP7 P55210 1/20 0.33

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
SCHEMBL9179167 0.80 MGLL (0.48) MGLLGAAALDH1A1NPSR1ELANE
SCHEMBL27348624 0.77 MGLL (0.45) MGLLGAAALDH1A1NPSR1ELANE
SCHEMBL3444955 0.77 ELANE (0.46) MGLLGAAALDH1A1NPSR1ELANE
SCHEMBL10631618 0.74 ELANE (0.35) MGLLGAAALDH1A1ELANENPC1
SCHEMBL31683720 0.73 TGM2 (0.39) ALDH1A1SMN1; SMN2HPGD
SCHEMBL9414033 0.69
SCHEMBL1955693 0.69
SCHEMBL488020 0.69
SCHEMBL756294 0.69
SCHEMBL17534935 0.69 MGLL (0.40) MGLLGAAALDH1A1NPSR1CES2

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
JP-4120004-A None JP disclosed
JP-H04120004-A ANTIMICROBIAL AND ANTIFUNGAL AGENT ICHIKAWA GOSEI KAGAKU KK 1992-04-21 JP disclosed