SCHEMBL4463363

SCHEMBL4463363

Cc1c(C(C)(C)c2cccc(C(C)(C)c3ccc(O)c(Cl)c3C)c2)ccc(O)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.44
ESR2 Q92731 4/20 0.44
CNR1 P21554 5/20 0.38
CNR2 P34972 5/20 0.38
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
KLF10 Q13118 1/20 0.35
TSHR P16473 1/20 0.34
TRPA1 O75762 1/20 0.34
ATM Q13315 1/20 0.34
ALOX15 P16050 3/20 0.33
ALOX12 P18054 1/20 0.33
P2RX1 P51575 1/20 0.33
RORC P51449 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HSD17B10 Q99714 2/20 0.32
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP3A4 P08684 2/20 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
SCHEMBL13593704 0.85 ESR1 (0.46) ESR1ESR2CNR1CNR2KLF10
SCHEMBL12339902 0.80 ESR1 (0.44) ESR1ESR2CNR1CNR2HDAC4
SCHEMBL4063769 0.79 ESR1 (0.47) ESR1ESR2CNR1CNR2HDAC4
SCHEMBL8987443 0.75 ESR1 (0.50) ESR1ESR2CNR1CNR2HDAC4
SCHEMBL4057111 0.74 ESR1 (0.48) ESR1ESR2CNR1CNR2HDAC4
SCHEMBL29599322 0.74 ESR1 (0.48) ESR1ESR2CNR1CNR2HDAC4
SCHEMBL1448894 0.72 ESR1 (0.60) ESR1ESR2CNR1CNR2HDAC4
SCHEMBL29599541 0.72 ESR1 (0.60) ESR1ESR2CNR1CNR2HDAC4
SCHEMBL27866164 0.72 ESR1 (0.48) ESR1ESR2CNR1CNR2TSHR
SCHEMBL4467655 0.72 ESR1 (0.60) ESR1ESR2CNR1CNR2HDAC4

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