SCHEMBL10485403

SCHEMBL10485403

CC(C)NCC(O)c1cccc(F)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.58
HIF1A Q16665 3/20 0.58
MEN1 O00255 2/20 0.58
CYP1A2 P05177 2/20 0.58
KMT2A Q03164 2/20 0.58
CYP2D6 P10635 1/20 0.58
ADRB2 P07550 6/20 0.57
ADRB1 P08588 5/20 0.57
ADRB3 P13945 4/20 0.57
MAPT P10636 3/20 0.57
MTOR P42345 2/20 0.57
KDM4E B2RXH2 2/20 0.57
MAPK1 P28482 2/20 0.57
HSD17B10 Q99714 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
ADRA1A P35348 2/20 0.57
ALDH1A1 P00352 1/20 0.57
LMNA P02545 1/20 0.57
CYP3A4 P08684 1/20 0.57
HPGD P15428 1/20 0.57

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
SCHEMBL30324664 1.00 TSHR (0.58) TSHRHIF1AMEN1CYP1A2KMT2A
SCHEMBL2297678 0.86 APAF1 (0.50) TSHRHIF1AMEN1CYP1A2KMT2A
SCHEMBL2299663 0.86 APAF1 (0.50) TSHRHIF1AMEN1CYP1A2KMT2A
SCHEMBL2293722 0.86 APAF1 (0.50) TSHRHIF1AMEN1CYP1A2KMT2A
SCHEMBL2297676 0.86 APAF1 (0.50) TSHRHIF1AMEN1CYP1A2KMT2A
SCHEMBL12186585 0.86 ADRB3 (0.51) ADRB2ADRB1ADRB3
SCHEMBL2298355 0.86 APAF1 (0.50) TSHRHIF1AMEN1CYP1A2KMT2A
SCHEMBL12186559 0.86 ADRB3 (0.51) ADRB2ADRB1ADRB3
SCHEMBL2293719 0.86 APAF1 (0.50) TSHRHIF1AMEN1CYP1A2KMT2A
SCHEMBL16559373 0.84 ADRB2 (0.48) TSHRHIF1AMEN1CYP1A2KMT2A

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-4861801-A Treatment of depression by using a fluorophenacylamine derivative Lafon, Laboratoire L. (FR) 1989-08-29 US disclosed
US-4835315-A Fluorophenacyl-amine derivatives and application thereof in therapeutics LABORATOIRE L. LAFON (FR) 1989-05-30 US disclosed
EP-0060954-B1 DERIVATIVES OF FLUOROPHENACYL AMINES AND THEIR THERAPEUTIC USE LABORATOIRE L. LAFON Société anonyme dite: (FR) 1984-08-15 EP disclosed
EP-0060954-A1 Derivatives of fluorophenacyl amines and their therapeutic use LABORATOIRE L. LAFON Société anonyme dite: (FR) 1982-09-29 EP disclosed