SCHEMBL4621133

SCHEMBL4621133

O/N=C1\C=CCc2c1oc1ccccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.34
MEN1 O00255 4/20 0.34
MAPK1 P28482 4/20 0.34
KMT2A Q03164 4/20 0.34
CYP3A4 P08684 4/20 0.34
LMNA P02545 3/20 0.34
TP53 P04637 3/20 0.34
CA12 O43570 3/20 0.34
CA1 P00915 3/20 0.34
CA9 Q16790 3/20 0.34
ALOX15 P16050 2/20 0.34
CA2 P00918 1/20 0.34
ABCB1 P08183 1/20 0.34
CALM1 P0DP23 1/20 0.34
AR P10275 1/20 0.34
PKM P14618 1/20 0.34
CYP1B1 Q16678 1/20 0.34
TSHR P16473 3/20 0.33
USP2 O75604 2/20 0.33
CASP1 P29466 2/20 0.33

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
SCHEMBL4619985 0.75 KDM4E (0.44) KDM4EMEN1MAPK1KMT2ACYP3A4
SCHEMBL2492937 0.70 KDM4E (0.40) KDM4EMEN1MAPK1KMT2ACYP3A4
SCHEMBL24727379 0.68 F2 (0.36) KDM4EMEN1KMT2ACA1CA2
SCHEMBL21663105 0.66 PTGS2 (0.37) KDM4EMEN1MAPK1KMT2ACYP3A4
SCHEMBL4711831 0.65 TDP1 (0.49) KDM4EMEN1MAPK1KMT2ACYP3A4
SCHEMBL17988319 0.63 KDM4E (0.50) KDM4EMEN1KMT2ACYP3A4CA12
SCHEMBL4619990 0.61 KDM4E (0.44) KDM4EMEN1MAPK1KMT2ACYP3A4
SCHEMBL7886466 0.61 HPGD (0.40) MEN1KMT2ALMNACA1CA2
SCHEMBL989525 0.60 KDM4E (0.41) KDM4EMEN1KMT2ATSHRALDH1A1
Dibenzofuran SCHEMBL28990435 0.60 KDM4E (0.58) KDM4EMEN1KMT2ACYP3A4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1885709-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES Pharmos Corporation (US) 2008-02-13 EP claimed
WO-2006129318-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES PHARMOS CORPORATION (US) 2006-12-07 WO claimed
EP-1885709-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES Pharmos Corporation (US) 2008-02-13 EP disclosed
WO-2006129318-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES PHARMOS CORPORATION (US) 2006-12-07 WO disclosed