SCHEMBL10779017

SCHEMBL10779017

Cc1c(C(=O)[C@@H](N)CCCNC(=N)N)c(=O)oc2cc(N)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.43
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
HSD17B10 Q99714 2/20 0.34
POLB P06746 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
CA9 Q16790 1/20 0.34
MAPT P10636 3/20 0.34
NPY4R P50391 3/20 0.33
NPY1R P25929 2/20 0.33
NPY2R P49146 2/20 0.33
NPY5R Q15761 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 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
SCHEMBL20522377 0.82 SRC (0.46) SRCKDM4EALDH1A1HPGDCA12
SCHEMBL3675110 0.82 SRC (0.46) SRCKDM4EALDH1A1HPGDCA12
SCHEMBL3675107 0.80 SRC (0.46) SRCKDM4EALDH1A1HPGDCA12
SCHEMBL3008956 0.79 QRFPR (0.37) SRCPOLBNPY4RNPY1RNPY2R
Arginine SCHEMBL27896326 0.78 ALDH1A1 (0.53) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL29436963 0.78 POLB (0.37) CA12CA1POLBMAPTNPY4R
SCHEMBL10783437 0.78 SRC (0.47) SRCKDM4EALDH1A1HPGDCA12
Arginine SCHEMBL29103422 0.78 ALDH1A1 (0.52) KDM4EALDH1A1HPGDCA12CA1
Arginine SCHEMBL29131390 0.78 ALDH1A1 (0.52) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL6705847 0.78 PTGER4 (0.44) KDM4EALDH1A1HPGD

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-0122148-B1 METHOD OF MEASURING THE NUMBER OF CELLS OF MICROORGANISMS AJINOMOTO CO., INC. (JP) 1987-12-16 EP disclosed
US-4675289-A MEASURING FLUORESCENCE OF RELEASED 7-AMINO-4-METHYL COURMARUN AJINOMOTO COMPANY, INCORPORATED (JP) 1987-06-23 US disclosed
EP-0122148-A1 Method of measuring the number of cells of microorganisms AJINOMOTO CO., INC. (JP) 1984-10-17 EP disclosed