SCHEMBL28033210

SCHEMBL28033210

O=C(c1ccccc1)c1ccc(Oc2cc(Br)ccc2Br)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 3/20 0.50
POLB P06746 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50
MAPT P10636 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ELANE P08246 1/20 0.46
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.46
PTGES O14684 1/20 0.44
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
STS P08842 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
SCHEMBL9761752 0.82 PARP10 (0.49) SRD5A2POLBCYP1A2CYP2D6HPGD
SCHEMBL811731 0.82 SLC6A4 (0.53) CYP1A2HPGDCYP2C19MAPTMEN1
SCHEMBL3839352 0.80 SRD5A2 (0.55) SRD5A2POLBCYP1A2CYP2D6HPGD
SCHEMBL29590141 0.79 SRD5A2 (0.54) SRD5A2POLBMAPTPTGDR2PTGES
SCHEMBL197581 0.79 SRD5A2 (0.54) SRD5A2POLBMAPTPTGDR2PTGES
SCHEMBL31164290 0.79 SRD5A2 (0.72) SRD5A2POLBMAPTMEN1KMT2A
SCHEMBL30054718 0.78 SRD5A2 (0.66) SRD5A2POLBMAPTMEN1KMT2A
SCHEMBL28928525 0.78 SRD5A2 (0.66) SRD5A2POLBMAPTMEN1KMT2A
SCHEMBL9419497 0.76 SRD5A2 (0.80) SRD5A2POLBELANESTSGAA
SCHEMBL9809047 0.76 SRD5A2 (0.80) SRD5A2POLBELANESTSGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102471494-B star polymer Robert Bosch Ltd. (DE) 2015-11-25 CN claimed