SCHEMBL6076241

SCHEMBL6076241

On1nncc1-c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.49
PTGS2 P35354 2/20 0.45
PTGS1 P23219 1/20 0.45
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
FYN P06241 2/20 0.37
MKNK1 Q9BUB5 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
KDM4E B2RXH2 2/20 0.36
POLB P06746 1/20 0.36
EGLN2 Q96KS0 1/20 0.35
GAA P10253 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL11280381 0.79 CYP1A2 (0.45) FLT3PTGS2PTGS1CA12CA9
SCHEMBL25220608 0.66 FLT3 (1.00) FLT3PTGS2PTGS1CA12CA9
SCHEMBL197346 0.60 BCL2L1 (0.55) CA9POLBNOTUMNPC1RAB9A
SCHEMBL26821699 0.60 BCL2L1 (0.55) CA9POLBNOTUMNPC1RAB9A
SCHEMBL12562793 0.60 BCL2L1 (0.55) CA9POLBNOTUMNPC1RAB9A
SCHEMBL10300262 0.60 BCL2L1 (0.55) CA9POLBNOTUMNPC1RAB9A
SCHEMBL6017000 0.60 RAB9A (0.47) KDM4EPOLBALDH1A1HTTMEN1
SCHEMBL14077014 0.59 GAA (0.54) FLT3PTGS2FYNMKNK1KDM4E
SCHEMBL17269527 0.58 BCL2L1 (0.48) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL23733877 0.58 BCL2L1 (0.48) KDM4EALDH1A1HTTMEN1KMT2A

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
US-7056941-B1 2-[pyrazolyl and triazolyl-3′-oxymethylene]-phenyl-isoxazolones, triazolones and tetrazolones as pesticides and fungicides BASF AKTIENGESELLSCHAFT (DE) 2006-06-06 US disclosed
EP-1000058-A1 2- PYRAZOLYL AND TRIAZOLYL-3'-OXYMETHYLENE]-PHENYL-ISOXAZOLONES, TRIAZOLONES AND TETRAZOLONES AS PESTICIDES AND FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-05-17 EP disclosed
WO-1999005139-A1 2-[PYRAZOLYL AND TRIAZOLYL-3'-OXYMETHYLENE]-PHENYL-ISOXAZOLONES, TRIAZOLONES AND TETRAZOLONES AS PESTICIDES AND FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1999-02-04 WO disclosed