SCHEMBL14537561

SCHEMBL14537561

CCC(COc1ccc(C(C)(C)c2ccc(OC)cc2)cc1)OC(=O)Nc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ GAA P10253 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPT P10636 1/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ KLK7 P49862 1/20 0.45
▸ AR P10275 1/20 0.43

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
SCHEMBL10014726 0.92 KMT2A (0.54) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL10014727 0.88 MEN1 (0.50) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL11508035 0.80 LMNA (0.55) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17637037 0.79 KMT2A (0.61) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17637042 0.78 NPSR1 (0.55) LMNAMEN1KMT2AHTTALDH1A1
SCHEMBL17637038 0.76 POLB (0.40) LMNAMEN1KMT2ASMN1; SMN2GAA
SCHEMBL13863485 0.75 AR (0.48) LMNAMEN1KMT2ASMN1; SMN2GAA
SCHEMBL11180860 0.75 CYP19A1 (0.42) LMNAMEN1KMT2AHTTALDH1A1
SCHEMBL13135883 0.73 MAPT (0.48) LMNATP53KMT2ASMN1; SMN2GAA
SCHEMBL6934183 0.72 AR (0.70) MEN1KMT2ASMN1; SMN2GAAHTT

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
US-8349942-B2 Intermediate transfer member XEROX CORPORATION (US) 2013-01-08 — — US disclosed
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