SCHEMBL172236

SCHEMBL172236

C=CC(=O)Oc1ccc(CCc2ccc(N(c3ccc(CCc4ccc(OC(=O)C=C)cc4)cc3)c3ccc(C(C)(C)c4ccc(OC(=O)C=C)cc4)cc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 7/20 0.61
ELANE P08246 1/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BCL2A1 Q16548 2/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
THRA P10827 4/20 0.35
POLB P06746 1/20 0.35
SRD5A1 P18405 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
AOC3 Q16853 1/20 0.35
PPARA Q07869 1/20 0.34

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
SCHEMBL12755201 0.92 THRB (0.54) THRBELANEALDH1A1KDM4ESMN1; SMN2
SCHEMBL11987133 0.89 THRB (0.71) THRBBCL2A1THRAMEN1KMT2A
SCHEMBL7214462 0.88 THRB (0.80) THRBELANEALDH1A1KDM4ESMN1; SMN2
SCHEMBL13777593 0.88 THRB (0.50) THRBALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL12755176 0.86 THRB (0.46) THRBALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL9915749 0.85 THRB (0.66) THRBSMN1; SMN2BCL2A1THRAKMT2A
SCHEMBL9915814 0.85 THRB (0.66) THRBSMN1; SMN2BCL2A1THRAKMT2A
SCHEMBL22605051 0.85 THRB (0.85) THRBALDH1A1SMN1; SMN2BCL2A1RAB9A
SCHEMBL12934710 0.84 THRB (0.64) THRBELANESMN1; SMN2BCL2A1RAB9A
SCHEMBL10102840 0.83 THRB (0.63) THRBALDH1A1SMN1; SMN2RAB9ANPC1

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-1847881-B1 Image forming apparatus, image forming method, and process cartridge RICOH CO LTD (JP) 2012-03-07 EP disclosed