SCHEMBL8499197

SCHEMBL8499197

[CH2]CCCCCCCCCCCCCCCC1CCNCC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 3/20 0.40
HRH3 Q9Y5N1 2/20 0.40
ITGB3 P05106 3/20 0.37
ITGA2B P08514 3/20 0.37
SLC6A4 P31645 2/20 0.36
SIGMAR1 Q99720 3/20 0.35
GNAI3 P08754 2/20 0.35
GNAI1 P63096 2/20 0.35
NAMPT P43490 1/20 0.35
FAAH O00519 1/20 0.34
TPSAB1 Q15661 1/20 0.33
TPSD1 Q9BZJ3 1/20 0.33
TPSG1 Q9NRR2 1/20 0.33
GBA1 P04062 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
SCHEMBL8498953 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8500266 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8496786 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8499727 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8496358 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8496012 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8499546 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8499258 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8501707 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4
SCHEMBL8499313 1.00 GNAO1 (0.40) GNAO1HRH3ITGB3ITGA2BSLC6A4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952316-A FOR TREATING AUTOIMMUNE DISEASES, E.G., RHEUMATIOD ARTHRITIS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1999-09-14 US disclosed
EP-0627406-B1 2-AMINO-1,3-PROPANEDIOL COMPOUND AND IMMUNOSUPPRESSANT YOSHITOMI PHARMACEUTICAL (JP) 1998-10-28 EP disclosed
US-5719176-A 2-amino-1,3-propanediol compound and immunosuppressant YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-02-17 US disclosed
US-5604229-A 2-amino-1,3-propanediol compound and immunosuppressant YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-02-18 US disclosed
EP-0627406-A1 2-AMINO-1,3-PROPANEDIOL COMPOUND AND IMMUNOSUPPRESSANT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-12-07 EP disclosed