SCHEMBL8913575

SCHEMBL8913575

O=C1Nc2ccc(Cl)cc2C1(Br)Br

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.51
MGAM O43451 1/20 0.47
HTR1A P08908 1/20 0.47
GAA P10253 1/20 0.47
SI P14410 1/20 0.47
HTR2A P28223 1/20 0.47
HTR7 P34969 1/20 0.47
HTR6 P50406 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47
AKR1B1 P15121 4/20 0.45
PDE7A Q13946 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PGR P06401 6/20 0.44
TGM2 P21980 1/20 0.43
CES1 P23141 1/20 0.43
CBX7 O95931 1/20 0.43
CDYL2 Q8N8U2 1/20 0.43
CDYL Q9Y232 1/20 0.43
CDY1; CDY1B Q9Y6F8 1/20 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
SCHEMBL5344885 0.85 AHR (0.46) IDO1AKR1B1PDE7ATGM2CES1
SCHEMBL5873792 0.78 LMNA (0.50) MGAMGAASIMGAM2AKR1B1
SCHEMBL2265588 0.78 IDO1 (0.53) IDO1MGAMHTR1AGAASI
SCHEMBL1722012 0.77 PGR (0.69) IDO1AKR1B1PDE7AMEN1KMT2A
SCHEMBL29224118 0.77 CYP1A2 (0.56) HTR7AKR1B1KMT2APGRAKR1A1
SCHEMBL30463281 0.77 CYP1A2 (0.56) HTR7AKR1B1KMT2APGRAKR1A1
SCHEMBL7471467 0.76 MAPT (0.50) IDO1MGAMHTR1AGAASI
SCHEMBL29860221 0.76 PGR (0.69) IDO1MGAMHTR1AGAASI
SCHEMBL26666506 0.76 PGR (0.69) IDO1MGAMHTR1AGAASI
SCHEMBL5345525 0.75 AKR1C3 (0.47) IDO1MGAMHTR1AGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0570817-B1 Process for the preparation of 5-chloroxindole LONZA AG (CH) 1997-04-23 EP disclosed
US-5395963-A Process for chloronitroacetic acid esters LONZA LTD. (CH) 1995-03-07 US disclosed
US-5284960-A Process for the production of 5-chloroxindole LONZA LTD. (CH) 1994-02-08 US disclosed
EP-0570817-A1 Process for the preparation of 5-chloroxindole LONZA A.G. (CH) 1993-11-24 EP disclosed
US-4885370-A Synthetic method for indol-2(3H)-ones PFIZER INC. (US) 1989-12-05 US disclosed
US-4761485-A Synthetic method for indol-2(3H)-ones PFIZER INC. (US) 1988-08-02 US disclosed