SCHEMBL4369764

SCHEMBL4369764

O=C1c2ccc(O)c(O)c2C(=O)N1Cc1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UBE2N P61088 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
MAPT P10636 3/20 0.47
RGS12 O14924 1/20 0.47
USP2 O75604 1/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
RECQL P46063 1/20 0.47
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CA1 P00915 1/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPK1 P28482 2/20 0.46
CACNA1G O43497 2/20 0.45
CA12 O43570 1/20 0.45
ALDH1A1 P00352 2/20 0.43
POLB P06746 2/20 0.43
HPGD P15428 2/20 0.43

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
SCHEMBL4366780 0.88 CA12 (0.43) UBE2NTDP1KMT2AMEN1MAPT
SCHEMBL13952387 0.85 KMT2A (0.48) KMT2AMEN1MAPTRGS12USP2
SCHEMBL4365961 0.84 KMT2A (0.47) TDP1KMT2AMEN1MAPTRGS12
SCHEMBL4368930 0.84 KDM4E (0.66) KMT2AMEN1MAPTRGS12USP2
SCHEMBL4370277 0.84 KMT2A (0.47) KMT2AMEN1MAPTRGS12USP2
SCHEMBL4372330 0.84 KMT2A (0.47) KMT2AMEN1MAPTRGS12USP2
SCHEMBL4374700 0.83 CASP3 (0.52) UBE2NKMT2AMEN1MAPTRGS12
SCHEMBL13952392 0.83 KMT2A (0.61) KMT2AMEN1MAPTRGS12USP2
SCHEMBL4366856 0.83 KMT2A (0.52) KMT2AMEN1MAPTRGS12USP2
SCHEMBL4370400 0.83 HDAC4 (0.42) KMT2AMEN1MAPTRGS12USP2

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
WO-2009026248-A2 HYDRAZIDE, AMIDE, PHTHALIMIDE AND PHTHALHYDRAZIDE ANALOGS AS INHIBITORS OF RETROVIRAL INTEGRASE THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, OFFICE OF TECHNOLOGY TRANSFER (US) 2009-02-26 WO claimed
WO-2009026248-A2 HYDRAZIDE, AMIDE, PHTHALIMIDE AND PHTHALHYDRAZIDE ANALOGS AS INHIBITORS OF RETROVIRAL INTEGRASE THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, OFFICE OF TECHNOLOGY TRANSFER (US) 2009-02-26 WO disclosed
WO-2009026248-A2 HYDRAZIDE, AMIDE, PHTHALIMIDE AND PHTHALHYDRAZIDE ANALOGS AS INHIBITORS OF RETROVIRAL INTEGRASE THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, OFFICE OF TECHNOLOGY TRANSFER (US) 2009-02-26 WO disclosed