SCHEMBL19872008

SCHEMBL19872008

CC(C)(C)Oc1ccc(C2(c3ccc(C(=O)C(C)(C)C)cc3)CCCCC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.60
▸ SLC6A4 P31645 4/20 0.48
▸ SLC6A3 Q01959 4/20 0.48
▸ SLC6A2 P23975 2/20 0.48
▸ ESR1 P03372 3/20 0.40
▸ ESR2 Q92731 3/20 0.40
▸ ALDH1A1 P00352 4/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PDE2A O00408 2/20 0.36
▸ PSMB1 P20618 1/20 0.36
▸ PSMB5 P28074 1/20 0.36
▸ PSMB2 P49721 1/20 0.36
▸ RXRA P19793 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ PPARA Q07869 1/20 0.33
▸ ELANE P08246 1/20 0.33

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
SCHEMBL15869211 0.85 SLC6A4 (0.61) ADORA3SLC6A4SLC6A3SLC6A2ESR1
SCHEMBL12101644 0.83 ADORA3 (0.56) ADORA3SLC6A4SLC6A3SLC6A2ESR1
SCHEMBL15869212 0.83 SLC6A4 (0.58) ADORA3SLC6A4SLC6A3SLC6A2ESR1
SCHEMBL12164518 0.82 ELANE (0.46) ADORA3SLC6A3SLC6A2MAPTLMNA
SCHEMBL12204977 0.81 ESR1 (0.65) ADORA3SLC6A4SLC6A3SLC6A2ESR1
SCHEMBL12015967 0.79 ADORA3 (0.55) ADORA3SLC6A4SLC6A3SLC6A2ALDH1A1
SCHEMBL21785623 0.78 ADORA3 (0.54) ADORA3SLC6A4SLC6A3SLC6A2ESR1
SCHEMBL22548773 0.77 ELANE (0.48) ALDH1A1MAPTHTTKDM4EPPARA
SCHEMBL18865538 0.77 PGR (0.42) MAPTPPARAELANE
SCHEMBL11577248 0.77 ADORA3 (0.70) ADORA3SLC6A4SLC6A3SLC6A2ESR1

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-10295918-B2 Electrophotographic photosensitive member, process cartridge, and image forming apparatus KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2019-05-21 — — US disclosed
US-20180046101-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2018-02-15 — — US disclosed
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