SCHEMBL12346030

SCHEMBL12346030

COc1ccc(C(C)(c2ccccc2)c2ccc(OC(=O)CCCCCCCCCCC(C)=O)c(C)c2)cc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 1/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ HPGD P15428 3/20 0.39
▸ AKR1C3 P42330 2/20 0.38
▸ TAS1R3 Q7RTX0 3/20 0.36
▸ TAS1R1 Q7RTX1 3/20 0.36
▸ KIF11 P52732 1/20 0.36
▸ FPR1 P21462 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ AKR1C2 P52895 1/20 0.35
▸ ATM Q13315 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HDAC6 Q9UBN7 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
SCHEMBL15001297 0.87 TOP2A (0.41) TOP2AHPGDTAS1R3TAS1R1FPR1
SCHEMBL14802308 0.87 TOP2A (0.41) TOP2AHPGDTAS1R3TAS1R1FPR1
SCHEMBL12345944 0.87 TOP2A (0.41) TOP2AHPGDTAS1R3TAS1R1FPR1
SCHEMBL15001286 0.87 TOP2A (0.41) TOP2AHPGDTAS1R3TAS1R1FPR1
SCHEMBL15001293 0.87 TOP2A (0.41) TOP2AHPGDTAS1R3TAS1R1FPR1
SCHEMBL15001287 0.86 TOP2A (0.40) TOP2AHPGDTAS1R3TAS1R1L3MBTL1
SCHEMBL15001280 0.83 L3MBTL1 (0.40) TOP2AESR1HPGDTAS1R3TAS1R1
SCHEMBL14580020 0.82 ESR1 (0.49) ESR1ESR2HPGDKDM4ETDP1
SCHEMBL12346028 0.81 SLC6A2 (0.44) TOP2AHPGDAKR1C3TAS1R3TAS1R1
SCHEMBL12345973 0.80 KMT2A (0.40) TOP2AMEN1KMT2AL3MBTL1TDP1

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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