SCHEMBL6205524

SCHEMBL6205524

CCOCC([O])c1cccc(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
AOC3 Q16853 3/20 0.44
ALOX15 P16050 1/20 0.43
MTNR1A P48039 4/20 0.43
MTNR1B P49286 4/20 0.43
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
CASR P41180 2/20 0.42
PARP1 P09874 1/20 0.40

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
SCHEMBL6202675 0.87 TP53 (0.46) L3MBTL1ALDH1A1
SCHEMBL10607023 0.83 L3MBTL1 (0.55) L3MBTL1AOC3MTNR1AMTNR1BCHRM2
SCHEMBL6203525 0.79 AOC3 (0.41) AOC3
SCHEMBL28729377 0.78 AOC3 (0.51) L3MBTL1ALDH1A1HPGDAOC3MTNR1A
SCHEMBL10435907 0.77 TSHR (0.42) L3MBTL1ALDH1A1
SCHEMBL10608596 0.75 L3MBTL1 (0.48) L3MBTL1AOC3MTNR1AMTNR1B
SCHEMBL2093766 0.75 L3MBTL1 (0.53) L3MBTL1ALDH1A1AOC3CHRM2CHRM1
SCHEMBL8883399 0.75 AOC3 (0.45) L3MBTL1ALDH1A1HPGDAOC3ALOX15
SCHEMBL6204864 0.73 L3MBTL1 (0.51) L3MBTL1ALDH1A1AOC3MTNR1AMTNR1B
SCHEMBL8053712 0.73 L3MBTL1 (0.51) L3MBTL1ALDH1A1AOC3CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506175-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-16 EP disclosed
WO-2003097609-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-11-27 WO disclosed