SCHEMBL9726893

SCHEMBL9726893

CCCCCC1(C(C)=O)C(=O)N(C)C(=O)N(c2ccccc2)C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.49
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
ALOX12 P18054 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CDC25B P30305 2/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
HTT P42858 2/20 0.37
CYP2C19 P33261 1/20 0.37
USP2 O75604 1/20 0.37
HSP90AA1 P07900 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37

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
SCHEMBL16865451 0.81 ELANE (0.51) ELANEALDH1A1CYP2C19MAPK1
SCHEMBL9180362 0.70 ELANE (0.43) ELANEKDM4EPKMMEN1GAA
SCHEMBL28024212 0.69 ALDH1A1 (0.41) ALOX12ALDH1A1MAPTTSHRMAPK1
SCHEMBL7590658 0.68 ELANE (0.56) ELANEKDM4EPKMMEN1GAA
SCHEMBL10952562 0.66 ELANE (1.00) ELANEKDM4EPKMMEN1KMT2A
SCHEMBL16867650 0.66 ELANE (0.43) ELANEKDM4EMEN1GAAKMT2A
SCHEMBL11774175 0.66 ELANE (0.50) ELANEMEN1GAAALOX12KMT2A
SCHEMBL9457060 0.65 KDM4E (0.61) ELANEKDM4EPKMMEN1GAA
SCHEMBL16865402 0.65 ELANE (0.48) ELANEPKMMEN1KMT2AALDH1A1
SCHEMBL3546835 0.65 KDM4E (0.50) ELANEKDM4EPKMMEN1GAA

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-4225965-A None JP disclosed
JP-H04225965-A INSECTICIDAL BARBITURIC ACID DERIVATIVE, ITS PREPARATION AND INSECTICIDAL COMPOSITION CONTAINING IT AS ACTIVE INGREDIENT DUPHAR INTERNATL RES BV 1992-08-14 JP disclosed