SCHEMBL19612640

SCHEMBL19612640

Clc1c(OCCc2ccccc2)cccc1OCCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.52
CYP11B1 P15538 3/20 0.49
CYP11B2 P19099 3/20 0.49
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
IDO1 P14902 1/20 0.46
GRM2 Q14416 1/20 0.46
HTR2C P28335 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR2B P41595 1/20 0.46
HTR6 P50406 1/20 0.46
GPR84 Q9NQS5 1/20 0.45
MAPK14 Q16539 1/20 0.45
KMT2A Q03164 1/20 0.44
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
PIN1 Q13526 1/20 0.43

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
SCHEMBL17912813 0.85 CYP11B1 (0.56) CYP11B1CYP11B2NPC1RAB9AIDO1
SCHEMBL9705397 0.84 L3MBTL1 (0.51) HPGDCYP11B1CYP11B2NPC1RAB9A
SCHEMBL1299790 0.84 HPGD (0.59) HPGDCYP11B1CYP11B2GRM2MAPK14
SCHEMBL19612460 0.82 HTR1A (0.56) HPGDCYP11B1CYP11B2NPC1RAB9A
SCHEMBL19612224 0.80 MAPT (0.66) CYP11B1CYP11B2NPC1RAB9AIDO1
SCHEMBL19612205 0.79 MAPT (0.64) HPGDNPC1RAB9AMAPK14KMT2A
SCHEMBL3084332 0.77 LMNA (0.52) HPGDCYP11B1CYP11B2NPC1RAB9A
SCHEMBL19612479 0.77 ABCB1 (0.53) CYP11B1CYP11B2
SCHEMBL8981682 0.77 KMT2A (0.69) HPGDSLC6A4GPR84KMT2ACNR1
SCHEMBL8764941 0.76 CYP11B1 (0.49) CYP11B1CYP11B2NPC1RAB9AIDO1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170336728-A1 ULTRAVIOLET CURABLE LIQUID COMPOSITION, ULTRAVIOLET CURING INKJET INK, ULTRAVIOLET CURING WET ELECTROPHOTOGRAPHIC LIQUID DEVELOPER, ULTRAVIOLET CURING ELECTROSTATIC INKJET INK, AND IMAGE FORMING METHOD USING THEREOF CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed