SCHEMBL4455722

SCHEMBL4455722

COCCOc1cc2c(cc1O)C1(CC2(C)C)CC(C)(C)c2cc(OCCOC)c(O)cc21

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.42
RXRA P19793 3/20 0.31
DRD2 P14416 1/20 0.31
DRD1 P21728 1/20 0.31
DRD3 P35462 1/20 0.31
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
RARG P13631 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
PLAU P00749 1/20 0.30

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
SCHEMBL4462226 0.96 OPRM1 (0.40) OPRM1RARARARBRARG
SCHEMBL4466037 0.93 OPRM1 (0.37) OPRM1RXRA
SCHEMBL12581594 0.89 KDM1A (0.35) OPRM1RXRARARARARBRARG
SCHEMBL4474023 0.87 RXRA (0.41) RXRADRD2DRD1DRD3RARA
SCHEMBL4459350 0.86 DRD1 (0.36) OPRM1RXRADRD2DRD1DRD3
SCHEMBL4459045 0.85 OPRM1 (0.33) OPRM1RXRA
SCHEMBL4464095 0.85 RXRA (0.33) OPRM1RXRA
SCHEMBL4467219 0.85 DRD1 (0.35) OPRM1RXRADRD2DRD1DRD3
SCHEMBL4460159 0.83 RXRA (0.38) OPRM1RXRADRD2DRD1DRD3
SCHEMBL4474208 0.83 ALDH1A1 (0.38) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582355-B2 Optical unit using plastic lenses FUJIFILM CORPORATION (JP) 2009-09-01 US disclosed
US-20060046065-A1 Optical unit using plastic lenses FUJI PHOTO FILM CO., LTD. 2006-03-02 US disclosed
US-6028161-A EXCELLENT TRANSPARENCY, HEAT RESISTANCE AND MECHANICAL PROPERTIES AND A LOW BIREFRINGENCE, MELT FLUIDITY AND MOLDABILITY; AN OPTICAL DISK, LENS AND AN OPTICAL FIBER MITSUI CHEMICALS, INC. (JP) 2000-02-22 US disclosed
EP-0926180-A2 A polycarbonate copolymer and applications thereof Mitsui Chemicals, Inc. (JP) 1999-06-30 EP disclosed