SCHEMBL11340451

SCHEMBL11340451

CCCc1ccc(-c2ccc(C(=O)Oc3ccc(C#N)cc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.57
THRB P10828 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
RAB9A P51151 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
POLB P06746 1/20 0.48
F2 P00734 1/20 0.48
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
HIF1A Q16665 1/20 0.47
MGLL Q99685 2/20 0.47
PLA2G1B P04054 1/20 0.47
KMT2A Q03164 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
PRSS1 P07477 1/20 0.46
ACR P10323 1/20 0.46

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
SCHEMBL11742330 0.96 MAPT (0.54) MAPTTHRBSMN1; SMN2RAB9AF2
SCHEMBL9758798 0.96 MAPT (0.54) MAPTTHRBSMN1; SMN2RAB9AF2
SCHEMBL4650974 0.96 MAPT (0.54) MAPTTHRBSMN1; SMN2RAB9AF2
SCHEMBL11733871 0.92 TSHR (0.58) MAPTTHRBSMN1; SMN2RAB9ATSHR
SCHEMBL13367303 0.92 TSHR (0.58) MAPTTHRBSMN1; SMN2RAB9ATSHR
SCHEMBL8903841 0.92 MAPT (0.51) MAPTTHRBSMN1; SMN2RAB9AF2
SCHEMBL11572716 0.91 TSHR (0.64) MAPTTHRBSMN1; SMN2RAB9ATSHR
SCHEMBL13063999 0.91 TSHR (0.64) MAPTTHRBSMN1; SMN2RAB9ATSHR
SCHEMBL10490550 0.91 TSHR (0.64) MAPTTHRBSMN1; SMN2RAB9ATSHR
SCHEMBL8377298 0.91 TSHR (0.64) MAPTTHRBSMN1; SMN2RAB9ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7923078-B2 Light-modulating liquid-crystal element ADEKA CORPORATION (JP) 2011-04-12 US disclosed
US-20090279043-A1 LIGHT-MODULATING LIQUID-CRYSTAL ELEMENT ADEKA CORPORATION (JP) 2009-11-12 US disclosed
US-4285829-A Liquid-crystalline dielectric MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1981-08-25 US disclosed