SCHEMBL7480165

SCHEMBL7480165

Fc1cnccc1NN1Cc2ccccc2C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 6/20 0.35
TGFBR2 P37173 5/20 0.35
EED O75530 1/20 0.35
TAS1R3 Q7RTX0 2/20 0.33
TAS1R1 Q7RTX1 2/20 0.33
TAS1R2 Q8TE23 2/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
IDO1 P14902 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
CFD P00746 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
HPGD P15428 1/20 0.32

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
Hydrochloric Acid SCHEMBL7484530 0.98 TGFBR1 (0.34) TGFBR1TGFBR2EEDTAS1R3TAS1R1
SCHEMBL9311407 0.75 HTR2C (0.40) EEDLMNAMAPTNPC1RAB9A
SCHEMBL8860096 0.73 HPGD (0.37) TGFBR1TGFBR2BCHEACHECFD
SCHEMBL7608055 0.73 TGFBR1 (0.38) TGFBR1TGFBR2BCHEACHELOXL2
SCHEMBL7481285 0.72 SLC6A2 (0.47) EED
SCHEMBL6589122 0.71 EED (0.45) EEDLOXL2MAPTHPGD
SCHEMBL9663897 0.71 SLC6A2 (0.56) TGFBR1TGFBR2BCHEACHECFD
Hydrochloric Acid SCHEMBL7482061 0.70 SLC6A2 (0.46) EED
Hydrochloric Acid SCHEMBL9665059 0.70 SLC6A2 (0.54) TGFBR1TGFBR2BCHEACHECFD
SCHEMBL7474470 0.70 CYP1A2 (0.46) LMNAHPGD

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
EP-0950056-B1 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP claimed
EP-0950056-A2 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS HOECHST MARION ROUSSEL, INC. (US) 1999-10-20 EP claimed
WO-1998029407-A2 N-(PYRIDINYLAMINO)ISOINDOLINES FOR TREATING ALZHEIMER'S AND DEPRESSION HOECHST MARION ROUSSEL, INC. (US) 1998-07-09 WO claimed
EP-0950056-B1 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP disclosed