SCHEMBL14614151

SCHEMBL14614151

CC(c1ccc(CN)cc1)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.42
LOXL2 Q9Y4K0 6/20 0.41
SLC6A4 P31645 1/20 0.40
ABAT P80404 1/20 0.39
F10 P00742 1/20 0.39
BACE1 P56817 1/20 0.38
TAAR1 Q96RJ0 2/20 0.38
PSIP1 O75475 1/20 0.36
ADRB2 P07550 1/20 0.36
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
NOS2 P35228 1/20 0.36
IDO1 P14902 1/20 0.36
PLG P00747 1/20 0.36
KLK1 P06870 1/20 0.36
KLK6 Q92876 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
NCOR2 Q9Y618 1/20 0.35

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
SCHEMBL13958028 0.82 TAAR1 (0.42) HRH3LOXL2SLC6A4ABATF10
SCHEMBL24974721 0.78 CA1 (0.38) SLC6A4IDO1
SCHEMBL18176237 0.78 PPARG (0.39) ADRB2NOS3NOS1
SCHEMBL5941506 0.77 HRH3 (0.41) HRH3LOXL2SLC6A4ABATF10
SCHEMBL84104 0.77 IDO1 (0.58) HRH3LOXL2ABATTAAR1PSIP1
SCHEMBL507696 0.75 HRH3 (0.39) HRH3LOXL2SLC6A4ABATBACE1
SCHEMBL14108220 0.75 LOXL2 (0.44) LOXL2ADRB2NOS3NOS1NOS2
SCHEMBL18642731 0.75 TAAR1 (0.44) HRH3LOXL2ABATF10BACE1
SCHEMBL13189390 0.75 ADRB2 (0.52) HRH3LOXL2ABATTAAR1PSIP1
SCHEMBL13367145 0.74 HRH3 (0.38) HRH3LOXL2SLC6A4ABATBACE1

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
EP-1752308-A1 Lithographic printing plate support, method of manufacturing the same, and presensitized plate Fuji Photo Film Co., Ltd. (JP) 2007-02-14 EP disclosed