SCHEMBL5969897

SCHEMBL5969897

Cc1ccccc1C(=O)NC1CCc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 9/20 0.64
TAS1R1 Q7RTX1 9/20 0.64
TAS1R2 Q8TE23 9/20 0.64
ALDH1A1 P00352 2/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
LMNA P02545 1/20 0.58
HSD17B10 Q99714 1/20 0.58
PDE2A O00408 1/20 0.58
PDE4A P27815 1/20 0.55
PDE4B Q07343 1/20 0.55
PDE4C Q08493 1/20 0.55
PDE4D Q08499 1/20 0.55
TDP1 Q9NUW8 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
SCHEMBL485043 0.83 MEN1 (0.51) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL485045 0.83 MEN1 (0.51) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL8516603 0.83 TAS1R3 (0.64) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL6361268 0.83 ALDH1A1 (0.85) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL13131227 0.82 MEN1 (0.49) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL484112 0.81 PDE4A (0.52) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL484111 0.81 PDE4A (0.52) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL3587605 0.81 CNR1 (0.60) TAS1R3TAS1R1TAS1R2ALDH1A1LMNA
SCHEMBL6615213 0.81 TAS1R3 (0.62) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL2077671 0.80 TAS1R3 (0.55) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1

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-0738149-B1 1-AMINOINDAN DERIVATIVES AND COMPOSITIONS THEREOF TEVA PHARMA (IL) 2006-11-29 EP disclosed