SCHEMBL180565

SCHEMBL180565

CC(C)N[C@H](C=O)Cc1c[nH]c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.60
HTR2A P28223 2/20 0.56
ADRB1 P08588 1/20 0.56
HTR1A P08908 1/20 0.56
ADRA2A P08913 1/20 0.56
SLC6A2 P23975 1/20 0.56
HTR1D P28221 1/20 0.56
HTR1B P28222 1/20 0.56
HTR2C P28335 1/20 0.56
HTR1E P28566 1/20 0.56
SLC6A4 P31645 1/20 0.56
HTR7 P34969 1/20 0.56
HTR2B P41595 1/20 0.56
HTR6 P50406 1/20 0.56
SLC6A3 Q01959 1/20 0.56
KDM4E B2RXH2 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPT P10636 2/20 0.55
APAF1 O14727 1/20 0.55
POLB P06746 1/20 0.55

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
SCHEMBL12126312 0.86 CTSL (0.62) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL15722175 0.86 CTSL (0.62) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL9728200 0.86 CTSL (0.62) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL14532871 0.85 CTSL (0.63) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL4407946 0.83 CTSL (0.63) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL16190432 0.83 CTSL (0.60) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL14532875 0.83 CTSL (0.60) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL14534876 0.83 CTSL (0.60) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL10063640 0.83 CTSL (0.64) CTSLHTR2AADRB1HTR1AADRA2A
SCHEMBL739201 0.82 HTR2A (0.66) HTR2AADRB1HTR1AADRA2ASLC6A2

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
WO-2015058025-A1 VAULTS ENGINEERED FOR HYDROPHOBIC DRUG DELIVERY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-04-23 WO disclosed
US-8674972-B2 Semiconductor device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-03-18 US disclosed
US-20120056861-A1 SEMICONDUCTOR DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-03-08 US disclosed