SCHEMBL6032432

SCHEMBL6032432

O=C(c1ccc(Oc2ccccc2)cc1)C1CCCCC1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
MAPK1 P28482 2/20 0.67
KDM2B Q8NHM5 3/20 0.60
SRD5A2 P31213 2/20 0.58
MGLL Q99685 1/20 0.55
POLB P06746 1/20 0.55
ELANE P08246 1/20 0.55
LMNA P02545 2/20 0.55
NPC1 O15118 1/20 0.55
GAA P10253 1/20 0.55
RAB9A P51151 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
PLA2G1B P04054 1/20 0.52
ATG4B Q9Y4P1 1/20 0.52
PARP10 Q53GL7 1/20 0.51
EPHX1 P07099 1/20 0.51
PKM P14618 1/20 0.51
HTT P42858 1/20 0.50

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
SCHEMBL19317518 0.91 ALDH1A1 (0.59) ALDH1A1MAPK1KDM2BSRD5A2MGLL
SCHEMBL31279890 0.91 ALDH1A1 (0.59) ALDH1A1MAPK1KDM2BSRD5A2MGLL
SCHEMBL4675888 0.84 MEN1 (0.58) ALDH1A1MAPK1KDM2BSRD5A2MGLL
SCHEMBL4675883 0.84 ALDH1A1 (0.53) ALDH1A1MAPK1KDM2BSRD5A2MGLL
SCHEMBL33443 0.84 SRD5A2 (0.67) SRD5A2MGLLPOLBELANERAB9A
SCHEMBL15155929 0.84 SRD5A2 (0.67) SRD5A2MGLLPOLBELANERAB9A
SCHEMBL1427963 0.84 SRD5A2 (0.67) SRD5A2MGLLPOLBELANERAB9A
Hydrochloric Acid SCHEMBL11617476 0.83 MEN1 (0.60) ALDH1A1MAPK1KDM2BSRD5A2MGLL
Diphenylether SCHEMBL27835073 0.82 ALDH1A1 (0.55) ALDH1A1MAPK1POLBELANELMNA
Bicarbonate SCHEMBL6612782 0.82 SRD5A2 (0.65) SRD5A2MGLLPOLBELANERAB9A

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
EP-1652833-A1 PROCESS FOR PRODUCING 4-HYDROXYDIPHENYL ETHER Sumitomo Chemical Company, Limited (JP) 2006-05-03 EP disclosed