SCHEMBL9301199

SCHEMBL9301199

C=C(c1ccc(Br)cc1)P(=O)(O)OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HTT P42858 1/20 0.39
HDAC3 O15379 3/20 0.38
HDAC1 Q13547 3/20 0.38
HDAC2 Q92769 3/20 0.38
OGG1 O15527 1/20 0.38
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
POLB P06746 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
CA12 O43570 1/20 0.37
MMP2 P08253 1/20 0.37
CA14 Q9ULX7 1/20 0.37
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36

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
SCHEMBL17289237 0.85 ALDH1A1 (0.46) KMT2AGAALMNANPC1RAB9A
SCHEMBL17289013 0.83 SMN1; SMN2 (0.43) KMT2AGAALMNANPC1HTT
SCHEMBL9714149 0.83 POLB (0.45) KMT2ALMNAPOLBMEN1NPSR1
SCHEMBL9300129 0.74 CES2 (0.46) KMT2AGAALMNANPC1RAB9A
SCHEMBL16868487 0.72 GAA (0.49) KMT2AGAALMNAHPGDNPC1
SCHEMBL9301191 0.72 MEN1 (0.43) KMT2ALMNARAB9AHDAC3HDAC1
SCHEMBL5051393 0.70 KMT2A (0.44) KMT2AGAALMNAHDAC1PTPN2
SCHEMBL7629194 0.68 CA2 (0.60) KMT2AGAALMNAPOLBMEN1
SCHEMBL16904240 0.68 NPC1 (0.55) HPGDNPC1RAB9AHDAC3HDAC1
SCHEMBL3364776 0.67 GAA (0.47) KMT2AGAALMNAPTPN2PTPN1

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
US-5310808-A Flame-retardant thermoplastic copolymers based on vinyl phosphonate derivatives grafted onto rubber ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1994-05-10 US disclosed
US-5292817-A Flame-retardant thermoplastic copolymers based on vinyl phosphonate derivatives grafted onto rubber ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1994-03-08 US disclosed