SCHEMBL18347553

SCHEMBL18347553

CCCCOC(=O)C(CC)CC(C)c1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.50
TSHR P16473 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2D6 P10635 2/20 0.50
CYP2C19 P33261 2/20 0.50
MAPK1 P28482 2/20 0.50
NR1H2 P55055 1/20 0.50
RNASEL Q05823 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
TDP1 Q9NUW8 4/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LTA4H P09960 2/20 0.40
NR5A1 Q13285 1/20 0.40
ALDH1A1 P00352 2/20 0.39

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
SCHEMBL18347550 0.92 ESR1 (0.47) ESR1TSHRSMN1; SMN2LMNACYP1A2
SCHEMBL15827673 0.87 CHRM2 (0.47) TSHRSMN1; SMN2LMNAMAPK1L3MBTL1
SCHEMBL19420345 0.82 ESR1 (0.49) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL14523149 0.82 NPC1 (0.43) TSHRSMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL12858496 0.81 TRPA1 (0.45) TSHRSMN1; SMN2LMNAMAPK1L3MBTL1
SCHEMBL11499291 0.79 SMN1; SMN2 (0.58) ESR1TSHRSMN1; SMN2LMNACYP1A2
SCHEMBL4848334 0.78 ALDH1A1 (0.54) ESR1TSHRSMN1; SMN2LMNACYP1A2
SCHEMBL16804936 0.77 ESR1 (0.46) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL388023 0.77 SMN1; SMN2 (0.60) ESR1TSHRSMN1; SMN2LMNACYP1A2
SCHEMBL25626561 0.77 SMN1; SMN2 (0.48) ESR1TSHRSMN1; SMN2LMNACYP1A2

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-9864285-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2018-01-09 US disclosed
US-20160378000-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2016-12-29 US disclosed