SCHEMBL12345946

SCHEMBL12345946

COc1cc(C)c(C(C)(C)c2c(C)cc(OC(=O)CCCCC(C)=O)cc2C)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ HSD17B10 Q99714 2/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ CYP3A4 P08684 3/20 0.34
▸ HPGD P15428 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ GAA P10253 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SLC6A3 Q01959 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
SCHEMBL14701064 0.79 KMT2A (0.42) KMT2ASMN1; SMN2POLBHSD17B10MEN1
SCHEMBL21537921 0.77 KMT2A (0.40) KMT2ASMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL9999552 0.75 KMT2A (0.47) KMT2ASMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL12346029 0.74 KMT2A (0.46) KMT2ASMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL12346026 0.74 KMT2A (0.46) KMT2ASMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL12346024 0.74 KMT2A (0.46) KMT2ASMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL9999550 0.74 KMT2A (0.46) KMT2ASMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL15001296 0.74 KMT2A (0.46) KMT2ASMN1; SMN2HSD17B10MEN1LMNA
SCHEMBL12346022 0.73 VCAM1 (0.39) KMT2ASMN1; SMN2POLBMEN1ALDH1A1
SCHEMBL12345973 0.73 KMT2A (0.40) KMT2ASMN1; SMN2HSD17B10MEN1LMNA

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
US-8404414-B2 Electrophotographic photoconductor and manufacturing method thereof FUJI ELECTRIC CO., LTD. (JP) 2013-03-26 — — US disclosed
US-20110189603-A1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR AND MANUFACTURING METHOD THEREOF FUJI ELECTRIC SYSTEMS CO., LTD. (JP) 2011-08-04 — — US disclosed
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