SCHEMBL9859579

SCHEMBL9859579

CCCOC(=O)CC(=O)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
ERCC5 P28715 1/20 0.50
FEN1 P39748 1/20 0.50
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
LMNA P02545 3/20 0.49
ALDH1A1 P00352 4/20 0.47
POLB P06746 3/20 0.47
KDM4E B2RXH2 2/20 0.47
GAA P10253 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
GSK3B P49841 2/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
NFKB1 P19838 1/20 0.47
CASP3 P42574 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SENP8 Q96LD8 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
SCHEMBL276803 0.86 SMN1; SMN2 (0.61) SMN1; SMN2ERCC5FEN1MEN1KMT2A
SCHEMBL2375373 0.83 LMNA (0.62) SMN1; SMN2ERCC5FEN1MEN1KMT2A
SCHEMBL9858937 0.83 ERCC5 (0.46) SMN1; SMN2ERCC5FEN1MEN1KMT2A
SCHEMBL26258777 0.83 HPGD (0.49) KMT2AALDH1A1KDM4ENPC1HDAC3
SCHEMBL4263364 0.82 SMN1; SMN2 (0.56) SMN1; SMN2ERCC5FEN1MEN1KMT2A
SCHEMBL7689720 0.81 ERCC5 (0.55) SMN1; SMN2ERCC5FEN1MEN1KMT2A
SCHEMBL1531237 0.80 ERCC5 (0.58) ERCC5FEN1MEN1KMT2ALMNA
SCHEMBL11087771 0.80 MMP1 (0.55) SMN1; SMN2ERCC5FEN1MEN1KMT2A
SCHEMBL197459 0.79 ALDH1A1 (0.70) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL7409439 0.79 SMN1; SMN2 (0.56) SMN1; SMN2ERCC5FEN1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0153127-B1 N-ARYL-3-ARYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOXAMIDES, PROCESSES FOR THEIR PRODUCTION, INSECTICIDAL COMPOSITIONS CONTAINING THEM AND METHODS FOR COMBATTING INSECTS ROHM AND HAAS COMPANY (US) 1991-04-03 EP disclosed
US-4863947-A PESTICIDES, INSECTICIDES ROHM AND HAAS (US) 1989-09-05 US disclosed
US-4663341-A Insecticidal n-aryl-3-aryl-4,5-dihydro-1h-pyrazole-1-carboxamides ROHM AND HAAS COMPANY (US) 1987-05-05 US disclosed
EP-0153127-A2 N-aryl-3-aryl-4,5-dihydro-1H-pyrazole-1-carboxamides, processes for their production, insecticidal compositions containing them and methods for combatting insects ROHM AND HAAS COMPANY (US) 1985-08-28 EP disclosed