SCHEMBL3630965

SCHEMBL3630965

O=Cc1ccccc1-c1cc(Cl)ccc1OCCCCBr

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
PTGER1 P34995 7/20 0.41
CYP2C9 P11712 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.39
ERN1 O75460 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
S1PR4 O95977 2/20 0.37
THRB P10828 1/20 0.36
CNR2 P34972 1/20 0.36
NCOA1 Q15788 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36

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
SCHEMBL9119355 0.82 KDM4E (0.52) ALDH1A1SMN1; SMN2HPGDHTTKDM4E
SCHEMBL11618301 0.78 PTGDR2 (0.58) PTGER1CYP2C9PTGDR2S1PR4THRB
SCHEMBL7903822 0.77 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2HPGDHTTCYP2C9
SCHEMBL11617431 0.77 PTGDR2 (0.57) PTGER1CYP2C9PTGDR2S1PR4THRB
SCHEMBL11617901 0.77 PTGDR2 (0.57) PTGER1CYP2C9PTGDR2S1PR4THRB
SCHEMBL11617436 0.77 PTGDR2 (0.57) PTGER1CYP2C9PTGDR2S1PR4THRB
SCHEMBL6930919 0.77 TDP1 (0.55) ALDH1A1SMN1; SMN2HTTERN1MEN1
SCHEMBL28518730 0.76 ALDH1A1 (0.69) ALDH1A1SMN1; SMN2HPGDHTTCYP2C9
SCHEMBL10482275 0.76 ALDH1A1 (0.69) ALDH1A1SMN1; SMN2HPGDHTTCYP2C9
SCHEMBL19328388 0.76 ALDH1A1 (0.69) ALDH1A1SMN1; SMN2HPGDHTTCYP2C9

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
EP-2142506-B1 NOVEL BENZOPHENONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2013-10-16 EP disclosed
EP-2142506-A1 NOVEL BENZOPHENONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF Council of Scientific&Industrial Research (IN) 2010-01-13 EP disclosed
WO-2008120235-A1 NOVEL BENZOPHENONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2008-10-09 WO disclosed