SCHEMBL9753866

SCHEMBL9753866

CCOc1ccc(C2(C(=O)Cl)CC(F)(F)C2(F)F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.40
NQO1 P15559 1/20 0.39
CNR2 P34972 1/20 0.39
KMT2A Q03164 3/20 0.38
NPC1 O15118 1/20 0.38
PLK1 P53350 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
TET3 O43151 1/20 0.38
FBXL19 Q6PCT2 1/20 0.38
CXXC5 Q7LFL8 1/20 0.38
TET1 Q8NFU7 1/20 0.38
KDM2B Q8NHM5 1/20 0.38
CXXC4 Q9H2H0 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38

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
SCHEMBL10540271 0.87 KMT2A (0.43) PARP10NQO1KMT2ANPC1PLK1
SCHEMBL9753539 0.87 KMT2A (0.43) PARP10NQO1KMT2ANPC1PLK1
Hydrochloric Acid SCHEMBL9753870 0.86 KMT2A (0.43) PARP10NQO1KMT2ANPC1PLK1
SCHEMBL11043611 0.85 GAA (0.40) PARP10NQO1KMT2ANPC1PLK1
SCHEMBL10543110 0.85 GAA (0.40) PARP10NQO1KMT2ANPC1PLK1
SCHEMBL10585508 0.82 NQO1 (0.44) PARP10NQO1CNR2KMT2ANPC1
SCHEMBL10933849 0.80 KMT2A (0.46) PARP10NQO1KMT2ANPC1PLK1
SCHEMBL9753868 0.78 PARP10 (0.38) PARP10NQO1CNR2KMT2ANPC1
SCHEMBL10934561 0.78 CA12 (0.35) PARP10KMT2ANPC1PLK1POLB
SCHEMBL9585939 0.77 GAA (0.43) PARP10NQO1KMT2ANPC1PLK1

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
WO-1991007380-A1 ARTHROPODICIDES DUNLENA PTY. LTD. (AU) 1991-05-30 WO disclosed
US-4849450-A INSECTICIDES, MITICIDES DUNLENA PTY. LTD. (AU) 1989-07-18 US disclosed
EP-0118283-B1 PHENYL-CYCLOBUTANE CARBOXYLATES AS ARTHROPODICIDES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1988-11-02 EP disclosed
EP-0118283-A1 Phenyl-cyclobutane carboxylates as arthropodicides COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1984-09-12 EP disclosed