SCHEMBL16838565

SCHEMBL16838565

C=CC(=O)OCC(CC)N1C(=O)c2ccc3c4c(ccc(c24)C1=O)C(=O)N(C(CC)CC)C3=O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
PIN1 Q13526 1/20 0.40
PIN4 Q9Y237 1/20 0.40
HPGD P15428 1/20 0.33
THRB P10828 3/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL25783976 0.77 THRB (0.37) TSHRPIN1PIN4HPGDTHRB
SCHEMBL27438424 0.76 TSHR (0.38) TSHRPIN1PIN4HPGDTHRB
SCHEMBL18351295 0.74 KDM4E (0.40) PIN1PIN4HPGDNPC1RAB9A
SCHEMBL27438532 0.73 THRB (0.34) TSHRPIN1PIN4THRB
SCHEMBL12382277 0.73 TERT (0.38) PIN1PIN4HPGDNPC1RAB9A
SCHEMBL18351287 0.72 PIN1 (0.37) PIN1PIN4NPC1RAB9AL3MBTL1
SCHEMBL19334645 0.71 PIN1 (0.47) TSHRPIN1PIN4THRBNPC1
SCHEMBL10018480 0.71 PRMT1 (0.40) PIN1PIN4HPGDL3MBTL1
SCHEMBL21693416 0.70 CYP1B1 (0.51) PIN1PIN4HPGDTHRBNPC1
SCHEMBL10261861 0.70 KDM4E (0.44) TSHRHPGD

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-9069267-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-06-30 US disclosed
US-9063505-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-06-23 US disclosed